SCHEMBL28582452

SCHEMBL28582452

N#Cc1ccccc1C(=O)c1cccc(O)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
CXCR2 P25025 1/20 0.41
ALDH1A1 P00352 4/20 0.40
CYP3A4 P08684 2/20 0.40
KMT2A Q03164 2/20 0.40
ALOX5 P09917 1/20 0.40
TSHR P16473 1/20 0.40
TERT O14746 1/20 0.40
CYP2C9 P11712 1/20 0.40
HSD17B14 Q9BPX1 3/20 0.39
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
HMGB1 P09429 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL9575558 0.87 GSTA1 (0.49) ALDH1A1CYP3A4KMT2ATSHRHPGD
SCHEMBL2913776 0.85 ALDH1A1 (0.45) ALDH1A1TSHRKDM4ECA1CA2
SCHEMBL11851267 0.84 CA1 (0.41) CXCR2ALDH1A1KMT2ATSHRHPGD
SCHEMBL245254 0.81 FNTA (0.58) FNTAFNTBALDH1A1CYP3A4KMT2A
SCHEMBL30740067 0.79 LIG1 (0.55) FNTAFNTBALDH1A1CYP3A4KMT2A
SCHEMBL301928 0.79 LIG1 (0.55) FNTAFNTBALDH1A1CYP3A4KMT2A
SCHEMBL29468156 0.75 HDAC1 (0.59) FNTAFNTBALDH1A1KMT2AALOX5
SCHEMBL273458 0.75 HDAC1 (0.59) FNTAFNTBALDH1A1KMT2AALOX5
SCHEMBL7636142 0.75 TSHR (0.55) ALDH1A1CYP3A4KMT2ATSHRCYP2C9
SCHEMBL9575703 0.75 MAPT (0.48) ALDH1A1TSHRKDM4ESMN1; SMN2LMNA

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-112974193-A Multilayer protective film with wear resistance 于瑞洋 2021-06-18 CN claimed
CN-112974193-A Multilayer protective film with wear resistance 于瑞洋 2021-06-18 CN disclosed