SCHEMBL29444884

SCHEMBL29444884

COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 1.00
KDR P35968 8/20 1.00
ERBB2 P04626 3/20 1.00
FBP1 P09467 3/20 1.00
SRC P12931 2/20 1.00
EPHB2 P29323 2/20 1.00
KDM4E B2RXH2 1/20 1.00
GAK O14976 1/20 1.00
MAPK13 O15264 1/20 1.00
ABL1 P00519 1/20 1.00
CYP1A2 P05177 1/20 1.00
CDK1 P06493 1/20 1.00
CYP3A4 P08684 1/20 1.00
CYP2D6 P10635 1/20 1.00
MAPT P10636 1/20 1.00
CYP2C9 P11712 1/20 1.00
TSHR P16473 1/20 1.00
MAPK1 P28482 1/20 1.00
CYP2C19 P33261 1/20 1.00
MAPK12 P53778 1/20 1.00

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
SCHEMBL9423 1.00 EGFR (1.00) EGFRKDRERBB2FBP1SRC
SCHEMBL30363011 1.00 EGFR (1.00) EGFRKDRERBB2FBP1SRC
Hydrochloric Acid SCHEMBL29369196 0.99 EGFR (1.00) EGFRKDRERBB2FBP1SRC
Hydrochloric Acid SCHEMBL93918 0.99 EGFR (1.00) EGFRKDRERBB2FBP1SRC
Hydrochloric Acid SCHEMBL30362813 0.99 EGFR (1.00) EGFRKDRERBB2FBP1SRC
SCHEMBL12963484 0.93 FBP1 (0.91) EGFRKDRERBB2FBP1SRC
SCHEMBL8349430 0.92 EGFR (0.91) EGFRKDRERBB2FBP1SRC
SCHEMBL4232360 0.91 FBP1 (0.84) EGFRKDRERBB2FBP1SRC
SCHEMBL22367416 0.91 FBP1 (1.00) EGFRKDRERBB2FBP1SRC
SCHEMBL4229994 0.90 EGFR (0.82) EGFRKDRERBB2FBP1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388602-A1 Tetrahydropyranopyrazole Derivatives for the Treatment of Cancer and Viral Infections GENASE THERAPEUTICS B V (NL) 2025-12-25 US disclosed
EP-4469461-B1 TETRAHYDROPYRANOPYRAZOLE DERIVATIVES FOR THE TREATMENT OF CANCER AND VIRAL INFECTIONS GENASE THERAPEUTICS B V (NL) 2025-10-15 EP disclosed
US-20250195668-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. 2025-06-19 US disclosed
US-12194002-B2 Compositions and methods to improve the therapeutic benefit of suboptimally administered chemical compounds including substituted hexitols such as dibromodulcitol BROWN DENNIS (US) 2025-01-14 US disclosed
EP-4469461-A1 TETRAHYDROPYRANOPYRAZOLE DERIVATIVES FOR THE TREATMENT OF CANCER AND VIRAL INFECTIONS Genase Therapeutics B.V. (NL) 2024-12-04 EP disclosed
CN-118946568-A Tetrahydropyranopyrazole derivatives for the treatment of cancer and viral infections 格纳赛治疗有限公司 2024-11-12 CN disclosed
CN-114656573-B Deimmunized shiga toxin a subunit scaffolds and cell targeting molecules comprising the same 分子模板公司 2024-09-27 CN disclosed
WO-2024189607-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR DISEASES TREATMENT DIDENKO KIRILL (MX) 2024-09-19 WO disclosed
CN-118141921-A Use of CAMK2 inhibitors for the preparation of a medicament for reducing resistance to EGFR-driven cancers 四川大学 2024-06-07 CN disclosed
EP-4320126-A2 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES The Broad Institute, Inc. (US) 2024-02-14 EP disclosed
WO-2022225728-A9 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. (US) 2022-11-17 WO disclosed
WO-2022225728-A2 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. (US) 2022-10-27 WO disclosed
US-20220281926-A1 DE-IMMUNIZED, SHIGA TOXIN A SUBUNIT SCAFFOLDS AND CELL-TARGETING MOLECULES COMPRISING THE SAME ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2022-09-08 US disclosed
CN-114656573-A Deimmunized shiga toxin a subunit scaffolds and cell targeting molecules comprising them 分子模板公司 2022-06-24 CN disclosed
US-11365223-B2 De-immunized, Shiga toxin a subunit scaffolds and cell-targeting molecules comprising the same MOLECULAR TEMPLATES, INC. (US) 2022-06-21 US disclosed
US-20220185903-A1 Novel bispecific binding molecule and drug conjugate thereof NANTONG YICHEN BIOPHARMA. CO. LTD. (CN) 2022-06-16 US disclosed
US-20220162271-A1 HER2-TARGETING MOLECULES COMPRISING DE-IMMUNIZED, SHIGA TOXIN A SUBUNIT SCAFFOLDS MOLECULAR TEMPLATES, INC. 2022-05-26 US disclosed
CN-107849096-B Deimmunized shiga toxin a subunit scaffolds and cell targeting molecules comprising them 分子模板公司 2022-05-24 CN disclosed
EP-3974424-A1 TETRAHYDROINDAZOLES AND MEDICAL USES THEREOF Genase Therapeutics B.V. (NL) 2022-03-30 EP disclosed
WO-2022020588-A9 CLINICAL METHODS FOR USE OF HER2 BINDING MOLECULES MOLECULAR TEMPLATES, INC. (US) 2022-03-17 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 (3 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-20250195668-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES COASY, JMJD7, PTMS EGFR 3560/4885KDR 3633/4885ERBB2 1173/4885
US-20250388602-A1 Tetrahydropyranopyrazole Derivatives for the Treatment of Cancer and Viral Infections CCNA1, KRAS, RSU1 EGFR 1747/4885KDR 2474/4885ERBB2 2129/4885
US-12194002-B2 Compositions and methods to improve the therapeutic benefit of suboptimally administered chemical compounds including substituted hexitols such as dibromodulcitol HEXD, DDOST, PAICS EGFR 2685/4885KDR 1640/4885ERBB2 2449/4885

“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.