SCHEMBL8624

SCHEMBL8624

c1cnc2ccc3ccc4cc[nH]c4c3c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.49
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
AXL P30530 1/20 0.42
NUDT1 P36639 1/20 0.42
MEN1 O00255 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
HTT P42858 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
HIF1A Q16665 1/20 0.40
CCNE2 O96020 1/20 0.37
CDK4 P11802 1/20 0.37
CCND1 P24385 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
NR4A2 P43354 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29852620 0.88 MAPT (0.54) CYP3A4MAPTKDM4ELMNASMN1; SMN2
SCHEMBL2087722 0.88 MAPT (0.54) CYP3A4MAPTKDM4ELMNASMN1; SMN2
SCHEMBL13166532 0.82 CYP3A4 (0.47) CYP3A4MAPTKDM4ELMNAAXL
SCHEMBL3825162 0.80 CYP3A4 (0.49) CYP3A4MAPTKDM4ELMNASMN1; SMN2
Imidazole SCHEMBL144265 0.77 CYP3A4 (0.42) CYP3A4MAPTKDM4ELMNASMN1; SMN2
SCHEMBL18416512 0.76 LMNA (0.52) CYP3A4MAPTKDM4ELMNASMN1; SMN2
SCHEMBL18740349 0.74 PARP1 (0.50) CYP3A4KDM4EHIF1ACCNE2CDK4
SCHEMBL28864050 0.73 CYP3A4 (0.74) CYP3A4MAPTKDM4ELMNASMN1; SMN2
SCHEMBL8604208 0.71 MAPT (0.50) CYP3A4MAPTKDM4ELMNASMN1; SMN2
Indole SCHEMBL28210661 0.71 CYP3A4 (0.69) CYP3A4MAPTKDM4ELMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1240 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034158-A1 METHODS OF TREATING CANCER OF THE CENTRAL NERVOUS SYSTEM COMPRISING 5-ETHYNYL-2'-DEOXYURIDINE UNIV NORTH CAROLINA CHAPEL HILL (US) 2026-02-05 US claimed
WO-2024020491-A1 METHODS OF TREATING CANCER OF THE CENTRAL NERVOUS SYSTEM COMPRISING 5-ETHYNYL-2'-DEOXYURIDINE THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2024-01-25 WO claimed
EP-3129014-B1 NOVEL ORGANOSELENIUM COMPOUNDS, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL USES THEREOF AS ANTITUMOUR AGENTS TETRAHEDRON (FR) 2021-05-12 EP claimed
EP-3515443-A1 COMBINED COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING A BENZOPHENONE THIAZOLE DERIVATIVES AS A VDA AND TOPOISOMERASE INHIBITOR Chong Kun Dang Pharmaceutical Corp. (KR) 2019-07-31 EP claimed
US-10308602-B2 Organoselenium compounds, method for producing same, and pharmaceutical uses thereof in particular as antitumor agents TETRAHEDRON (FR) 2019-06-04 US claimed
US-9980953-B2 Combined composition for preventing or treating cancer comprising a benzophenone thiazole derivatives as a VDA and topoisomerase inhibitor CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-05-29 US claimed
WO-2018056620-A1 COMBINED COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING A BENZOPHENONE THIAZOLE DERIVATIVES AS A VDA AND TOPOISOMERASE INHIBITOR CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-03-29 WO claimed
US-20180085363-A1 COMBINED COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING A BENZOPHENONE THIAZOLE DERIVATIVES AS A VDA AND TOPOISOMERASE INHIBITOR NATIONAL CANCER CENTER (KR) 2018-03-29 US claimed
US-20170114011-A1 NOVEL ORGANOSELENIUM COMPOUNDS, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL USES THEREOF IN PARTICULAR AS ANTITUMOR AGENTS TETRAHEDRON (FR) 2017-04-27 US claimed
EP-3129014-A2 NOVEL ORGANOSELENIUM COMPOUNDS, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL USES THEREOF AS ANTITUMOUR AGENTS Tetrahedron (FR) 2017-02-15 EP claimed
US-20010020038-A1 Method for inhibiting or treating chemotherapy-induced hair loss BRISTOL-MYERS SQUIBB COMPANY 2001-09-06 US claimed
EP-0986302-A1 A METHOD OF TREATING CANCER Merck & Co., Inc. (US) 2000-03-22 EP claimed
WO-1998054966-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 1998-12-10 WO claimed
EP-0667771-B1 ANTITUMOUR COMPOSITIONS CONTAINING TAXANE DERIVATIVES RHONE POULENC RORER SA (FR) 1998-04-15 EP claimed
EP-0667771-A1 ANTITUMOUR COMPOSITIONS CONTAINING TAXANE DERIVATIVES Aventis Pharma S.A. (FR) 1995-08-23 EP claimed
WO-1994010995-A1 ANTITUMOUR COMPOSITIONS CONTAINING TAXANE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1994-05-26 WO claimed
EP-0558613-A1 PYRIDOBENZOINDOLE DERIVATIVES, THEIR PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 1993-09-08 EP claimed
WO-1992009602-A1 PYRIDOBENZOINDOLE DERIVATIVES, THEIR PREPARATION METHOD, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1992-06-11 WO claimed
US-5091388-A PYRIDOBENZOINDOLE DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS WHICH CONTAIN THEM RHONE-POULENC SANTE (FR) 1992-02-25 US claimed
EP-0402232-A1 Pyridobenzoindole derivatives, their preparation and compositions containing them RHONE-POULENC SANTE (FR) 1990-12-12 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010020038-A1 Method for inhibiting or treating chemotherapy-induced hair loss MGMT, TUBB2B, CCAR2 CYP3A4 2286/4885MAPT 3457/4885KDM4E 960/4885
US-20260034158-A1 METHODS OF TREATING CANCER OF THE CENTRAL NERVOUS SYSTEM COMPRISING 5-ETHYNYL-2'-DEOXYURIDINE NSUN2, MKI67, DUT CYP3A4 4761/4885MAPT 872/4885KDM4E 1027/4885
US-20170114011-A1 NOVEL ORGANOSELENIUM COMPOUNDS, METHOD FOR PRODUCING SAME, AND PHARMACEUTICAL USES THEREOF IN PARTICULAR AS ANTITUMOR AGENTS SCLY, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SLC7A5 CYP3A4 1291/4885MAPT 4699/4885KDM4E 3293/4885
US-10308602-B2 Organoselenium compounds, method for producing same, and pharmaceutical uses thereof in particular as antitumor agents SCLY, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PRMT5 CYP3A4 952/4885MAPT 4575/4885KDM4E 3047/4885
US-20180085363-A1 COMBINED COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING A BENZOPHENONE THIAZOLE DERIVATIVES AS A VDA AND TOPOISOMERASE INHIBITOR TOP1, TOP2A, TOP2B CYP3A4 593/4885MAPT 3546/4885KDM4E 3049/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.