SCHEMBL14157710

SCHEMBL14157710

NC(=O)C12CC3CC(C1)C(CNC(=O)c1ccc(-c4ccc(C(F)(F)F)cc4)[nH]1)C(C3)C2

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 15/20 0.44
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ HSD11B2 P80365 2/20 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
SCHEMBL14157692 0.88 HSD11B1 (0.41) HSD11B1HSD11B2
SCHEMBL14157685 0.79 HSD11B1 (0.39) HSD11B1HSD11B2
SCHEMBL14157708 0.79 HSD11B1 (0.41) HSD11B1CYP3A4CYP2D6CYP2C9HSD11B2
SCHEMBL14157702 0.74 MEN1 (0.45) HSD11B1HSD11B2
SCHEMBL14157677 0.67 HSD11B1 (0.41) HSD11B1
SCHEMBL15706812 0.67 HSD11B1 (0.52) HSD11B1HSD11B2
SCHEMBL14157643 0.67 HSD11B1 (0.52) HSD11B1HSD11B2
SCHEMBL31518178 0.66 KIF11 (0.49) —
SCHEMBL14157575 0.65 HSD11B1 (0.43) HSD11B1HSD11B2
Hydrochloric Acid SCHEMBL30729484 0.65 KIF11 (0.47) —

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-2699560-A2 5-CARBAMOYL-ADAMANTAN-2-YL AMIDE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AND PREPARATION PROCESS THEREOF SK Biopharmaceuticals Co., Ltd. (KR) 2014-02-26 — — EP disclosed
WO-2012169863-A2 5-CARBAMOYL-ADAMANTAN-2-YL AMIDE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AND PREPARATION PROCESS THEREOF SK BIOPHARMACEUTICALS CO., LTD. (KR) 2012-12-13 — — WO disclosed
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