SCHEMBL234550

SCHEMBL234550

[c]1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12.[c]1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL356683 1.00 CYP3A4 (0.42) CYP3A4TDP1ESR1ESR2KDM4E
SCHEMBL4619337 0.98 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2KDM4E
SCHEMBL16180769 0.98 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2KDM4E
SCHEMBL5330004 0.90 ESR1 (0.36) CYP3A4TDP1ESR1ESR2
SCHEMBL4744273 0.86 CYP3A4 (0.31) CYP3A4TDP1
SCHEMBL1443600 0.85 CYP2A6 (0.35) TDP1
SCHEMBL900597 0.82
SCHEMBL1460886 0.82 CYP2A6 (0.35) CYP3A4TDP1
SCHEMBL3632076 0.81 HSD17B2 (0.33)
SCHEMBL8913546 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12091395-B2 Griseofulvin compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-09-17 US claimed
WO-2024151992-A1 PREPARATION OF A TYK2 INHIBITOR VENTYX BIOSCIENCES, INC. (US) 2024-07-18 WO claimed
US-20240150309-A1 GRISEOFULVIN COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-05-09 US claimed
EP-4132902-A1 PD-CATALYZED AMINATION OF FLUORINATED ARYL CHLORIDES BASF SE (DE) 2023-02-15 EP claimed
EP-2482978-B1 HETEROGENEOUS RHODIUM METAL CATALYSTS UNIV ALBERTA (CA) 2018-05-09 EP claimed
WO-2012173572-A1 STEREOSELECTIVE SYNTHESIS OF HIGHLY SUBSTITUTED ENAMIDES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2012-12-20 WO claimed
EP-2482978-A1 HETEROGENEOUS RHODIUM METAL CATALYSTS The Governors Of The University Of Alberta (CA) 2012-08-08 EP claimed
WO-2011035445-A1 HETEROGENEOUS RHODIUM METAL CATALYSTS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2011-03-31 WO claimed
EP-2203438-A1 CYANOISOQUINOLINE H. Lundbeck A/S (DK) 2010-07-07 EP claimed
EP-2134710-A1 SUBSTITUTED HETEROCYCLE FUSED GAMMA-CARBOLINES SYNTHESIS Intra-Cellular Therapies, Inc. (US) 2009-12-23 EP claimed
EP-1799652-A1 N-BENZENESULFONYL SUBSTITUTED ANILINO-PYRIMIDINE ANALOGS Wyeth (US) 2007-06-27 EP claimed
WO-2007045593-A2 NAPHTHYL DERIVATIVES AS INHIBITORS OF BETA-AMYLOID AGGREGATION SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-04-26 WO claimed
WO-2007025693-A1 PROCESS FOR THE PRODUCTION OF ANILINES SYNGENTA PARTICIPATIONS AG (CH) 2007-03-08 WO claimed
EP-1730123-A1 NOVEL AMINATION PROCESS AstraZeneca AB (SE) 2006-12-13 EP claimed
WO-2006044457-A1 N-BENZENESULFONYL SUBSTITUTED ANILINO-PYRIMIDINE ANALOGS WYETH (US) 2006-04-27 WO claimed
WO-2005108338-A1 NOVEL THERAPEUTIC AGENTS FOR THE TREATMENT OF CANCER, METABOLIC DISEASES AND SKIN DISORDERS AUSPEX PHARMACEUTICALS (US) 2005-11-17 WO claimed
WO-2005090318-A1 NOVEL AMINATION PROCESS ASTRAZENECA AB (SE) 2005-09-29 WO claimed
EP-1100774-A1 IMPROVED ARYLAMINE SYNTHESIS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2001-05-23 EP claimed
WO-2000005199-A1 IMPROVED ARYLAMINE SYNTHESIS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2000-02-03 WO claimed
WO-1995008526-A1 HYDROGENATION PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1995-03-30 WO 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 (2 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-20240150309-A1 GRISEOFULVIN COMPOUND PTGS1, CYP11B1, GRIA1 CYP3A4 333/4885TDP1 4416/4885ESR1 1192/4885
US-12091395-B2 Griseofulvin compound PTGS1, CYP11B1, GRIA1 CYP3A4 333/4885TDP1 4416/4885ESR1 1192/4885

“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.