SCHEMBL7813650

SCHEMBL7813650

CCCc1ccc2c(nc(CC)n2C2CC2)c1-c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.31
BRD4 O60885 5/20 0.31
CREBBP Q92793 5/20 0.31
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30
EP300 Q09472 2/20 0.30

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
SCHEMBL7814352 0.78 HCAR1 (0.34)
SCHEMBL7816969 0.74 CCNT1 (0.40) CYP11B2CCNT1CDK9
SCHEMBL7817046 0.71 POLB (0.33)
SCHEMBL7813827 0.70 CCNT1 (0.45) CCNT1CDK9
SCHEMBL7814171 0.68 LMNA (0.38)
SCHEMBL22623697 0.59 LMNA (0.50) CYP11B2
SCHEMBL14417403 0.59 CYP11B1 (0.46) CYP11B2CCNT1CDK9
SCHEMBL7816959 0.59 CRHBP (0.37) CYP11B2BRD4CREBBP
SCHEMBL23946257 0.58 CYP11B2 (0.58) CYP11B2
SCHEMBL7813559 0.58 TLR8 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1091941-A1 NOVEL BENZIMIDAZOLES AS CORTICOTROPIN RELEASE FACTOR ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2001-04-18 EP claimed
WO-2000001675-A1 NOVEL BENZIMIDAZOLES AS CORTICOTROPIN RELEASE FACTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 2000-01-13 WO claimed