SCHEMBL8346964

SCHEMBL8346964

COC(=CC=Cc1cc2ccccc2[nH]1)C(=O)NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATP6V1B1 P15313 5/20 0.68
ATP6AP1 Q15904 1/20 0.47
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 1/20 0.41
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
ACKR3 P25106 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL8346962 1.00 ATP6V1B1 (0.68) ATP6V1B1ATP6AP1KDM4EMEN1KMT2A
SCHEMBL8346958 1.00 ATP6V1B1 (0.68) ATP6V1B1ATP6AP1KDM4EMEN1KMT2A
SCHEMBL8350868 0.84 ATP6V1B1 (0.67) ATP6V1B1ATP6AP1KDM4EALDH1A1ACKR3
SCHEMBL8350872 0.84 ATP6V1B1 (0.67) ATP6V1B1ATP6AP1KDM4EALDH1A1ACKR3
SCHEMBL8350863 0.84 ATP6V1B1 (0.67) ATP6V1B1ATP6AP1KDM4EALDH1A1ACKR3
SCHEMBL6291922 0.84 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1KDM4EPDGFRBPDGFRA
SCHEMBL6291927 0.84 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1KDM4EPDGFRBPDGFRA
SCHEMBL6291924 0.84 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1KDM4EPDGFRBPDGFRA
SCHEMBL6291675 0.81 ATP6V1B1 (0.75) ATP6V1B1ATP6AP1KDM4EMEN1KMT2A
SCHEMBL6291678 0.81 ATP6V1B1 (0.75) ATP6V1B1ATP6AP1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5981525-A FOR THERAPY OR PROPHYLAXIS OF OSTEOPOROSIS,TUMOURS, ULCERS, AUTOIMMUNE DISEASES, LIPIDEMIC DISORDERS, HYPERCHOLESTEROLEMIC AND ATHEROSCLEROTIC DISEASES, AIDS ALZHEIMER'S DISEASE SMITHKLINE BEECHAM CORPORATION (US) 1999-11-09 US disclosed
EP-0802902-A1 INDOLE DERIVATIVES USEFUL IN THE TREATMENT OF OSTEOPOROSIS Smithkline Beecham S.p.A. (IT) 1997-10-29 EP disclosed
WO-1996021644-A1 INDOLE DERIVATIVES USEFUL IN THE TREATMENT OF OSTEOPOROSIS SMITHKLINE BEECHAM S.P.A. (IT) 1996-07-18 WO disclosed