SCHEMBL8931090

SCHEMBL8931090

CCB(CC)c1cncc(C)c1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.36
ATM Q13315 1/20 0.33
CYP2A6 P11509 3/20 0.32

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
SCHEMBL2216611 0.77 SMYD3 (0.32)
SCHEMBL18417966 0.75 HCAR2 (0.40) HCAR2ATMCYP2A6
SCHEMBL1942394 0.74 CYP11B1 (0.39)
SCHEMBL2424327 0.74 ATM (0.34) HCAR2ATMCYP2A6
SCHEMBL1942335 0.74 CYP11B1 (0.33)
SCHEMBL30941538 0.73 HCAR2 (0.43) HCAR2ATMCYP2A6
SCHEMBL144194 0.73 HCAR2 (0.43) HCAR2ATMCYP2A6
SCHEMBL20312299 0.72 CYP19A1 (0.31)
SCHEMBL15926784 0.71 HCAR2 (0.42) HCAR2ATMCYP2A6
SCHEMBL1942145 0.71 ATM (0.41) ATM

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
US-5618807-A Method for preparing 17-substituted steroids useful in cancer treatment BRITISH TECHNOLOGY GROUP LIMITED (GB) 1997-04-08 US disclosed
US-5604213-A STEROID DEPENDENT CANCERS SUCH AS PROSTATE AND BREAST CANCER BRITISH TECHNOLOGY GROUP LIMITED (GB) 1997-02-18 US disclosed