SCHEMBL10154840

SCHEMBL10154840

CCC1CN(c2ccc(C)nc2)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.44
CHRNB2 P17787 3/20 0.43
CHRNA4 P43681 3/20 0.43
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
MAPT P10636 2/20 0.37
CHRNA7 P36544 1/20 0.37
USP1 O94782 1/20 0.37
WDR48 Q8TAF3 1/20 0.37
CHRM4 P08173 1/20 0.36
RAB9A P51151 1/20 0.36
PIK3CA P42336 2/20 0.36
MTOR P42345 2/20 0.36
SLC6A9 P48067 1/20 0.36

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
SCHEMBL15859901 0.86 CDK1 (0.45) ELANECHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL25065163 0.86 PIK3CA (0.46) ELANECHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL13154920 0.83 CHRNB2 (0.41) ELANECHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL27854325 0.80 MAPT (0.50) ELANECHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL18664830 0.79 CHRNB4 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3MAPT
SCHEMBL10150979 0.79 CHRNB4 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3MAPT
SCHEMBL14845638 0.79 CHRNB2 (0.45) ELANECHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL15492575 0.76 CHRNB2 (0.61) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL18479425 0.76 CHRNB2 (0.47) CHRNB2CHRNA4CHRNB4CHRNA3MAPT
SCHEMBL24156931 0.76 MAPT (0.60) CHRNB2CHRNA4CHRNB4CHRNA3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9765087-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2017-09-19 US disclosed
US-20170114046-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARM INC (US) 2017-04-27 US disclosed
US-20140341851-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-11-20 US disclosed
US-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-07-10 US disclosed
US-8673954-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2014-03-18 US disclosed
US-8507522-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-8101643-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2010-10-14 US disclosed
US-20100233122-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2010-09-16 US 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-20170114046-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 ELANE 2040/4885CHRNB2 4878/4885CHRNA4 4796/4885
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 ELANE 1168/4885CHRNB2 4879/4885CHRNA4 4831/4885
US-20100233122-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 ELANE 2040/4885CHRNB2 4878/4885CHRNA4 4796/4885
US-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 ELANE 2040/4885CHRNB2 4878/4885CHRNA4 4796/4885
US-20140341851-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 ELANE 2040/4885CHRNB2 4878/4885CHRNA4 4796/4885

“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.