SCHEMBL9580259

SCHEMBL9580259

CC(C)(C)NC(=O)C1=C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC[C@@]4(C)CC[C@@H]32)NC1=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 4/20 0.45
SRD5A2 P31213 3/20 0.45
LMNA P02545 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
ABCC4 O15439 1/20 0.45
ABCB11 O95342 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
HSD3B1 P14060 1/20 0.45
NFKB1 P19838 1/20 0.45
MAPK1 P28482 1/20 0.45
THPO P40225 1/20 0.45
BLM P54132 1/20 0.45
MBOAT4 Q96T53 3/20 0.43
GRIN1 Q05586 2/20 0.36
GRIN2B Q13224 2/20 0.36
CYP19A1 P11511 3/20 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
SCHEMBL9134492 0.91 MBOAT4 (0.40) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL10698417 0.85 MBOAT4 (0.45) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL7643438 0.84 MBOAT4 (0.47) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL4807036 0.84 MBOAT4 (0.47) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL5580932 0.83 MBOAT4 (0.41) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL8564986 0.82 MBOAT4 (0.40) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL8569642 0.82 MBOAT4 (0.40) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL9235530 0.81 MBOAT4 (0.39) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL9574629 0.81 MBOAT4 (0.62) SRD5A1SRD5A2LMNACYP3A4CYP2C9
SCHEMBL8978606 0.81 MBOAT4 (0.39) CYP3A4MBOAT4GRIN1GRIN2BCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111484542-B Treatment method of finasteride mother liquor 湖北葛店人福药业有限责任公司 2024-01-30 CN disclosed
CN-115607517-A Finasteride tablet and preparation method thereof 山东新时代药业有限公司 2023-01-17 CN disclosed
CN-113876733-A Finasteride tablet and preparation method thereof 湖南百草制药有限公司 2022-01-04 CN disclosed
EP-0542802-A1 STIMULATION OF HAIR GROWTH WITH POTASSIUM CHANNEL OPENERS AND 5-g(a)-REDUCTASE INHIBITORS. UPJOHN CO (US) 1993-05-26 EP disclosed
WO-1992002225-A1 STIMULATION OF HAIR GROWTH WITH POTASSIUM CHANNEL OPENERS AND 5α-REDUCTASE INHIBITORS THE UPJOHN COMPANY (US) 1992-02-20 WO disclosed