SCHEMBL7958583

SCHEMBL7958583

NC(=O)c1cc2ccccc2n1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 6/20 0.51
CCR2 P41597 4/20 0.48
F10 P00742 2/20 0.47
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
DAO P14920 1/20 0.43
F2 P00734 1/20 0.42
MCL1 Q07820 1/20 0.42
ALOX15 P16050 1/20 0.42
SRD5A1 P18405 1/20 0.41
SRD5A2 P31213 1/20 0.41

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
SCHEMBL7492984 0.88 CCR2 (0.57) PLA2G10CCR2ALDH1A1TSHRDAO
SCHEMBL2460494 0.81 NOD2 (0.56) CCR2F10ALDH1A1TSHR
SCHEMBL4102690 0.79 PLA2G10 (0.49) PLA2G10CCR2F10ALDH1A1TSHR
SCHEMBL30310782 0.76 PLA2G10 (0.40) PLA2G10CCR2F10MCL1
SCHEMBL1573798 0.75 PLA2G10 (0.78) PLA2G10CCR2F10F2
SCHEMBL8584166 0.74 CCR2 (0.55) PLA2G10CCR2ALDH1A1TSHRDAO
SCHEMBL29572644 0.74 ALDH1A1 (0.52) CCR2F10ALDH1A1TSHRSRD5A1
SCHEMBL5186269 0.74 PLA2G10 (0.51) PLA2G10CCR2F10ALDH1A1TSHR
SCHEMBL28109529 0.74 PLA2G10 (0.64) PLA2G10CCR2F10ALDH1A1MCL1
SCHEMBL29604362 0.74 ALDH1A1 (0.47) PLA2G10ALDH1A1TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214856-B1 TREATING NEURODEGENERATIVE DISORDERS, E.G., ALZHEIMER'S DISEASE, STROKES, TRAUMATIC BRAIN INJURY; ANTIISCHEMIC AGENTS; MUSCULAR DYSTROPHY; ALSO CATARACTS; PLATELET AGGREGATION SMITHKLINE BEECHAM CORPORATION 2001-04-10 US disclosed