SCHEMBL16599716

SCHEMBL16599716

Nc1ccc(-c2ccc(N)c(O)c2)cc1O.Nc1cccc(C(=O)O)c1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP7 P55210 2/20 0.56
▸ G6PD P11413 1/20 0.56
▸ CASP6 P55212 1/20 0.56
▸ ALOX15 P16050 3/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ CYP3A4 P08684 2/20 0.55
▸ KDM4E B2RXH2 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ GFER P55789 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.53
▸ MMP2 P08253 1/20 0.51
▸ PPM1B O75688 1/20 0.51
▸ MCL1 Q07820 3/20 0.50
▸ ACMSD Q8TDX5 6/20 0.49
▸ HNF4A P41235 2/20 0.49
▸ DHFR P00374 1/20 0.45
▸ HDAC1 Q13547 1/20 0.43
▸ XDH P47989 1/20 0.43
▸ SLC22A12 Q96S37 1/20 0.43
▸ IKBKB O14920 1/20 0.42

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
SCHEMBL30797265 0.82 G6PD (0.65) CASP7G6PDCASP6ALOX15HSD17B10
SCHEMBL73593 0.82 G6PD (0.65) CASP7G6PDCASP6ALOX15HSD17B10
SCHEMBL27503726 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
SCHEMBL3659543 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
Hydrochloric Acid SCHEMBL4923242 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
Ammonia Solution, Strong SCHEMBL1224707 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
Hydrochloric Acid SCHEMBL5223248 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
SCHEMBL27529027 0.80 G6PD (0.63) CASP7G6PDCASP6ALOX15HSD17B10
SCHEMBL23270907 0.79 CYP3A4 (0.52) CASP7G6PDCASP6ALOX15HSD17B10
Carbamic Acid SCHEMBL5529842 0.79 G6PD (0.61) CASP7G6PDCASP6ALOX15HSD17B10

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
WO-2015047711-A1 POLYBENZOXAZOLE MEMBRANES FROM SELF-CROSS-LINKABLE AROMATIC POLYIMIDE MEMBRANES UOP LLC (US) 2015-04-02 — — WO disclosed
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