SCHEMBL1365376

SCHEMBL1365376

N#Cc1ccc(F)c(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.46
TRPV4 Q9HBA0 2/20 0.43
CYP11B2 P19099 2/20 0.43
CYP11B1 P15538 1/20 0.43
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
S1PR3 Q99500 1/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
KHK P50053 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
VCAM1 P19320 1/20 0.37

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
SCHEMBL31621318 0.84 AR (0.50) ARTRPV4HTR2AHTR2CHTR2B
SCHEMBL10733139 0.84 AR (0.50) ARTRPV4HTR2AHTR2CHTR2B
SCHEMBL30424420 0.84 CYP11B2 (0.42) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL2730532 0.84 CYP11B2 (0.42) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL3333071 0.84 CYP11B2 (0.42) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL7869818 0.82 CYP11B2 (0.41) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL3338599 0.82 AR (0.43) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL220882 0.80 AR (0.53) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL4478973 0.80 CYP11B2 (0.40) ARTRPV4CYP11B2CYP11B1HTR2A
SCHEMBL24495511 0.80 AR (0.45) ARTRPV4CYP11B2CYP11B1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3774774-B1 PYRIDINE SUBSTITUTED 2,2'-DI-9H-CARBAZOL-9-YL-[1,1'-BIPHENYL]-DICARBONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-07-13 EP claimed
EP-3774774-A1 PYRIDINE-SUBSTITUTED 2,2'-DI-9H-CARBAZOL-9-YL-[1,1'-BIPHENYL]DICARBONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OPTOELECTRONIC APPARATUSES cynora GmbH (DE) 2021-02-17 EP claimed
WO-2019197407-A1 PYRIDINE-SUBSTITUTED 2,2'-DI-9H-CARBAZOL-9-YL-[1,1'-BIPHENYL]DICARBONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OPTOELECTRONIC APPARATUSES CYNORA GMBH (DE) 2019-10-17 WO claimed
EP-0731087-A1 Process for the preparation of 2,4-dichloro-5-fluorobenzonitrile and 2,6-dichloro-3-fluorobenzonitrile BAYER AG (DE) 1996-09-11 EP claimed
JP-8245542-A None JP disclosed
EP-3774774-B1 PYRIDINE SUBSTITUTED 2,2'-DI-9H-CARBAZOL-9-YL-[1,1'-BIPHENYL]-DICARBONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-07-13 EP disclosed
US-11325922-B2 Process for the preparation of Crisaborole in a stable crystal form OLON S.P.A. (IT) 2022-05-10 US disclosed
EP-3728167-B1 A PROCESS FOR THE PREPARATION OF CRISABOROLE OLON SPA (IT) 2021-12-01 EP disclosed
EP-3851429-A1 A PROCESS FOR THE PURIFICATION OF CRISABOROLE OLON S.p.A. (IT) 2021-07-21 EP disclosed
US-20210070781-A1 A PROCESS FOR THE PREPARATION OF CRISABOROLE OLON S.P.A. (IT) 2021-03-11 US disclosed
EP-3774774-A1 PYRIDINE-SUBSTITUTED 2,2'-DI-9H-CARBAZOL-9-YL-[1,1'-BIPHENYL]DICARBONITRILE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN OPTOELECTRONIC APPARATUSES cynora GmbH (DE) 2021-02-17 EP disclosed
US-20200407377-A1 PROCESS FOR THE PREPARATION OF CRISABOROLE IN A STABLE CRYSTAL FORM OLON S.P.A. (IT) 2020-12-31 US disclosed
US-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2010-02-18 US disclosed
US-20090253758-A1 Selective androgen receptor modulators ELLIPSES PHARMA LTD (GB) 2009-10-08 US disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 WO disclosed
EP-1911743-A1 CYCLIC AMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
EP-1911743-A1 CYCLIC AMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
US-5670694-A AMMOXIDATION OF CORRESPONDING TOLUENE BAYER AKTIENGESELLSCHAFT (DE) 1997-09-23 US disclosed
JP-H08245542-A PREPARATION OF 2,4-DICHLORO-5-FLUOROBENZONITRILE AND 2,5-DICHLORO-3-3FLUOROBENZONITRILE BAYER AG 1996-09-24 JP disclosed
EP-0731087-A1 Process for the preparation of 2,4-dichloro-5-fluorobenzonitrile and 2,6-dichloro-3-fluorobenzonitrile BAYER AG (DE) 1996-09-11 EP 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 (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-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS AR, SHBG, IGF1R AR 1/4885TRPV4 3628/4885CYP11B2 29/4885
US-11325922-B2 Process for the preparation of Crisaborole in a stable crystal form FGB, SQLE, UGT2B17 AR 3815/4885TRPV4 4499/4885CYP11B2 56/4885
US-20200407377-A1 PROCESS FOR THE PREPARATION OF CRISABOROLE IN A STABLE CRYSTAL FORM FGB, SQLE, UGT2B17 AR 3815/4885TRPV4 4499/4885CYP11B2 56/4885
US-20210070781-A1 A PROCESS FOR THE PREPARATION OF CRISABOROLE SQLE, CYP11B1, UGT2B17 AR 4521/4885TRPV4 4517/4885CYP11B2 9/4885
US-20090253758-A1 Selective androgen receptor modulators AR, SHBG, GPR119 AR 1/4885TRPV4 3034/4885CYP11B2 26/4885

“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.