SCHEMBL28007620

SCHEMBL28007620

CC(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.60
PPARD Q03181 2/20 0.60
PPARA Q07869 2/20 0.60
TYR P14679 7/20 0.59
CD209 Q9NNX6 3/20 0.50
SYNJ2 O15056 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ABL1 P00519 1/20 0.49
ALPL P05186 1/20 0.49
POLB P06746 1/20 0.49
ALPI P09923 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
ALPG P10696 1/20 0.49
PABPC1 P11940 1/20 0.49
RECQL P46063 1/20 0.49
GALK1 P51570 1/20 0.49
CASP7 P55210 1/20 0.49
CASP6 P55212 1/20 0.49
MCL1 Q07820 1/20 0.49

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
SCHEMBL28707080 1.00 PPARG (0.60) PPARGPPARDPPARATYRCD209
SCHEMBL28707074 0.88 TACR1 (0.55) PPARGPPARDPPARATYRCD209
SCHEMBL3636324 0.87 SYNJ2 (0.59) PPARGPPARDPPARATYRCD209
SCHEMBL28712306 0.87 PPARG (0.47) PPARGPPARDPPARATYRCD209
SCHEMBL28707077 0.87 TACR1 (0.50) PPARGPPARDPPARATYRCD209
SCHEMBL28717582 0.87 SLC5A1 (0.48) PPARGPPARDPPARATYRCD209
SCHEMBL28703695 0.86 PPARG (0.46) PPARGPPARDPPARATYRCD209
SCHEMBL28481672 0.85 PPARG (0.59) PPARGPPARDPPARATYRCD209
SCHEMBL28712353 0.84 TYR (0.56) PPARGPPARDPPARATYRCD209
SCHEMBL18821486 0.84 TYR (0.57) PPARGPPARDPPARATYRKDM4E

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
CN-104606485-B A kind of black hair Chinese medicine composition and its granule 浙江中医药大学 2018-03-27 CN disclosed
CN-104606485-A Hair-blacking traditional Chinese medicine composition as well as granules thereof UNIV ZHEJIANG CHINESE MEDICAL 2015-05-13 CN disclosed