SCHEMBL1890983

SCHEMBL1890983

CC1=C(C2=C(C)C(=O)c3c(cc(O)c(O)c3C(C)C)C2=O)C(=O)c2cc(O)c(O)c(C(C)C)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.42
CDK4 P11802 3/20 0.42
CCND1 P24385 3/20 0.42
BCL2 P10415 4/20 0.41
MCL1 Q07820 4/20 0.41
BCL2L1 Q07817 2/20 0.41
BCL2L2 Q92843 1/20 0.41
BID P55957 1/20 0.37
BCL2A1 Q16548 1/20 0.37
ACLY P53396 3/20 0.35
MEN1 O00255 4/20 0.34
MAPT P10636 4/20 0.34
KMT2A Q03164 4/20 0.34
ESR1 P03372 3/20 0.34
ESR2 Q92731 3/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP1A1 P04798 2/20 0.34
CYP3A4 P08684 2/20 0.34
ALOX15 P16050 2/20 0.34

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
SCHEMBL19419611 0.94 BCL2 (0.41) EGFRCDK4CCND1BCL2MCL1
SCHEMBL22686504 0.86 ALB (0.42) EGFRCDK4CCND1BCL2MCL1
SCHEMBL22700473 0.86 AKR1B1 (0.36) EGFRCDK4CCND1BCL2MCL1
SCHEMBL19038888 0.80 BCL2 (0.43) EGFRCDK4CCND1BCL2MCL1
SCHEMBL22700390 0.78 MCL1 (0.50) BCL2MCL1MEN1MAPTKMT2A
SCHEMBL22700400 0.78 MAPT (0.36) BCL2MCL1MEN1MAPTKMT2A
SCHEMBL22700489 0.77 BCL2 (0.40) BCL2MCL1MEN1KMT2AHSD17B10
SCHEMBL1890942 0.77 BCL2 (0.37) EGFRCDK4CCND1BCL2MCL1
SCHEMBL22700774 0.77 CNR2 (0.34) MAPTALDH1A1ALOX15MAPK1HSD17B10
SCHEMBL22700765 0.77 SMN1; SMN2 (0.32) KMT2AALDH1A1L3MBTL1TSHR

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369618-A1 ASYMMETRIC DERIVATIVES OF POLYPHENOLS OF THE DINAPHTHALINE SERIES, PROCESS OF PREPARING AND USE THEREOF Nearmedic International Limited (CY) 2020-11-26 US disclosed
US-10195213-B2 Chemical entities that kill senescent cells for use in treating age-related disease UNITY BIOTECHNOLOGY, INC. (US) 2019-02-05 US disclosed
US-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES UNITY BIOTECHNOLOGY, INC. 2017-10-05 US disclosed
US-20150313906-A1 COMBINATION GLAXOSMITHKLINE LLC 2015-11-05 US disclosed
US-20150313906-A1 COMBINATION GLAXOSMITHKLINE LLC 2015-11-05 US disclosed
US-8937193-B2 Apogossypolone derivatives as anticancer agents SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-01-20 US disclosed
US-8937193-B2 Apogossypolone derivatives as anticancer agents SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-01-20 US disclosed
US-8937193-B2 Apogossypolone derivatives as anticancer agents SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-01-20 US disclosed
US-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-05-12 US disclosed
US-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-05-12 US disclosed
US-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-05-12 US disclosed
US-20090118377-A1 APOGOSSYPOLONE AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-05-07 US disclosed
US-20090118377-A1 APOGOSSYPOLONE AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-05-07 US disclosed
EP-1824467-A4 APOGOSSYPOLONE AND THE USES THEREOF UNIV MICHIGAN (US) 2008-12-31 EP disclosed
EP-1824467-A2 APOGOSSYPOLONE AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-08-29 EP disclosed
US-20060178435-A1 Apogossypolone and the uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-08-10 US disclosed
WO-2006050447-A2 APOGOSSYPOLONE AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-05-11 WO disclosed

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

For each of this compound's patents that has machine-readable text (7 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-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES TP53, NQO1, SHMT2 EGFR 3068/4885CDK4 88/4885CCND1 155/4885
US-20200369618-A1 ASYMMETRIC DERIVATIVES OF POLYPHENOLS OF THE DINAPHTHALINE SERIES, PROCESS OF PREPARING AND USE THEREOF DNM2, DNM1, MAVS EGFR 4699/4885CDK4 331/4885CCND1 200/4885
US-20060178435-A1 Apogossypolone and the uses thereof BCL2, BAD, BAX EGFR 1727/4885CDK4 281/4885CCND1 141/4885
US-20110112112-A1 APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS CYP17A1, HSD17B7, CYP27A1 EGFR 2765/4885CDK4 1904/4885CCND1 1659/4885
US-20090118377-A1 APOGOSSYPOLONE AND THE USES THEREOF BCL2, BAD, BAX EGFR 1727/4885CDK4 281/4885CCND1 141/4885
US-10195213-B2 Chemical entities that kill senescent cells for use in treating age-related disease TP53, CDKN1A, GLA EGFR 1846/4885CDK4 21/4885CCND1 96/4885
US-20150313906-A1 COMBINATION EZH2, BMI1, DOT1L EGFR 1087/4885CDK4 185/4885CCND1 2059/4885

“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.