SCHEMBL9468166

SCHEMBL9468166

O=C(C1=C(O)C(O)C(O)(O)C=C1)c1ccccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIG1 P18858 1/20 0.40
HPGD P15428 8/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 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
CA9 Q16790 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
CA14 Q9ULX7 1/20 0.38
GSTA1 P08263 2/20 0.37
HSD17B10 Q99714 4/20 0.37
MAPT P10636 4/20 0.37
TSHR P16473 3/20 0.37
HIF1A Q16665 2/20 0.35

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
SCHEMBL29044405 0.85 SPR (0.38) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL424985 0.71 LIG1 (0.41) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
2,2'-Dihydroxybenzphenone SCHEMBL29572496 0.68 HPGD (0.67) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
2,2'-Dihydroxybenzphenone SCHEMBL18422 0.68 HPGD (0.67) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL23677754 0.66 LMNA (0.44) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL455832 0.66 LIG1 (0.64) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
2,2'-Dihydroxybenzphenone SCHEMBL6652370 0.66 LIG1 (0.64) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
2,2'-Dihydroxybenzphenone SCHEMBL11145317 0.66 LIG1 (0.64) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL1719339 0.62 HPGD (0.44) LIG1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL21802003 0.62 LIG1 (0.87) LIG1HPGDKDM4EALDH1A1SMN1; SMN2

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
US-5268252-A Polyol with o-naphthoquinone-2-diazide-4-sulfonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1993-12-07 US disclosed
US-4812551-A CRESOL OR PHENOL, PRINTED CIRCUITS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-03-14 US disclosed