SCHEMBL1260022

SCHEMBL1260022

N#Cc1cc2nc(C(O)C(F)(F)F)[nH]c2cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.37
SCN10A Q9Y5Y9 3/20 0.36
AR P10275 5/20 0.36
TRPA1 O75762 1/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL12919495 0.84 CSNK1D (0.46) SCN10AALPLALPIALPGKDM4E
SCHEMBL12894033 0.76 CACNA1H (0.37) CACNA1HSCN10AALPLALPIALPG
SCHEMBL20096687 0.76 CACNA1H (0.41) CACNA1HARTRPA1
SCHEMBL20096569 0.76 CACNA1H (0.41) CACNA1HARTRPA1
SCHEMBL1258416 0.74 ALPL (0.45) SCN10AALPLALPIALPGKDM4E
SCHEMBL1635569 0.74 AR (0.40) CACNA1HARTRPA1
SCHEMBL1260391 0.73 KDM4E (0.47) SCN10AALPLALPIALPGKDM4E
SCHEMBL1258546 0.73 AR (0.51) CACNA1HSCN10AARALPLALPI
SCHEMBL12712490 0.73 AR (0.51) CACNA1HSCN10AARALPLALPI
SCHEMBL12712487 0.73 AR (0.51) CACNA1HSCN10AARALPLALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812406-B1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2018-09-12 EP disclosed
EP-1805147-B1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2014-08-13 EP disclosed
US-8586616-B2 Benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA, NV (BE) 2013-11-19 US disclosed
US-20110086883-A1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) NG RAYMOND 2011-04-14 US disclosed
US-7879895-B2 prepared by mixing 1-(5,6-dichloro-1H-benzimidazol-2-yl)-2,2,2-trifluoro-ethanol with a carrier; non-steroidal agonists and antagonists; anticarcinogenic agents prostates; alopecia; eating disorders; acne; AIDS; cachexia JANSSEN PHARMACEUTICA NV (BE) 2011-02-01 US disclosed
US-20100324095-A1 PHARMACEUTICAL COMPOSITION FOR INHIBITING AMYLOID-BETA PROTEIN ACCUMULATION SUMITOMO CHEMICAL COMPANY, LIMITED 2010-12-23 US disclosed
US-20100298383-A1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) NG RAYMOND 2010-11-25 US disclosed
EP-2246334-A1 MEDICINAL COMPOSITION FOR INHIBITING AMYLOID- PROTEIN DEPOSITION Sumitomo Chemical Company, Limited (JP) 2010-11-03 EP disclosed
US-7795446-B2 Benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-20090258909-A1 Novel Benzimidazole Derivatives Useful as Selective Androgen Receptor Modulators (SARMS) NG RAYMOND 2009-10-15 US disclosed
US-7566733-B2 Benzimidazole derivatives useful as selective androgen receptor modulators (sarms) JANSSEN PHARMACEUTICA N.V. (BE) 2009-07-28 US disclosed
US-7566733-B2 Benzimidazole derivatives useful as selective androgen receptor modulators (sarms) JANSSEN PHARMACEUTICA N.V. (BE) 2009-07-28 US disclosed
US-20080119522-A1 5,6-dichloro-2-(2,2,2-trifluoro-ethyl)-1H-benzimidazole for example; use for prostate cancer, benign prostatic hyperplasia (BPH), hirsutism, alopecia, anorexia nervosa, breast cancer, acne, AIDS, cachexia, as a male contraceptive, and/or as a male performance enhancer NG RAYMOND 2008-05-22 US disclosed
US-7348438-B2 Benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-25 US disclosed
EP-1812406-A2 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-01 EP disclosed
US-20060116412-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (sarms) JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-01 US disclosed
US-20060111402-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-25 US disclosed
WO-2006039215-A2 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-04-13 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-20110086883-A1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, ESRRA CACNA1H 4263/4885SCN10A 3024/4885AR 1/4885
US-20090258909-A1 Novel Benzimidazole Derivatives Useful as Selective Androgen Receptor Modulators (SARMS) AR, NR5A1, ESRRA CACNA1H 4263/4885SCN10A 3024/4885AR 1/4885
US-20100298383-A1 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, ESRRA CACNA1H 4263/4885SCN10A 3024/4885AR 1/4885
US-20100324095-A1 PHARMACEUTICAL COMPOSITION FOR INHIBITING AMYLOID-BETA PROTEIN ACCUMULATION APP, PSEN1, APBA1 CACNA1H 1762/4885SCN10A 149/4885AR 3720/4885
US-20060111402-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) AR, NR5A1, ESRRA CACNA1H 4263/4885SCN10A 3024/4885AR 1/4885
US-20080119522-A1 5,6-dichloro-2-(2,2,2-trifluoro-ethyl)-1H-benzimidazole for example; use for prostate cancer, benign prostatic hyperplasia (BPH), hirsutism, alopecia, anorexia nervosa, breast cancer, acne, AIDS, cachexia, as a male contraceptive, and/or as a male performance enhancer AR, FSHR, BRDT CACNA1H 4641/4885SCN10A 4677/4885AR 1/4885
US-20060116412-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (sarms) AR, NR5A1, ESRRA CACNA1H 4263/4885SCN10A 3024/4885AR 1/4885

“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.