SCHEMBL8070939

SCHEMBL8070939

Nc1cccc(C(=O)O)c1C(=O)O.[NaH]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.61
G6PD P11413 1/20 0.50
CASP7 P55210 1/20 0.50
CASP6 P55212 1/20 0.50
ALDH1A1 P00352 3/20 0.48
ALOX15 P16050 1/20 0.48
CDC25B P30305 2/20 0.46
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
NAPRT Q6XQN6 2/20 0.44
IDO1 P14902 1/20 0.44
KDM4E B2RXH2 3/20 0.44
HSD17B10 Q99714 2/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
AKR1C3 P42330 1/20 0.43

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
SCHEMBL29367294 0.98 MMP2 (0.63) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL27925721 0.98 MMP2 (0.63) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL15869337 0.98 MMP2 (0.63) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL48723 0.98 MMP2 (0.63) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL8070950 0.96 MMP2 (0.61) MMP2G6PDCASP7CASP6ALDH1A1
Hydrazine SCHEMBL28369279 0.96 MMP2 (0.61) MMP2G6PDCASP7CASP6ALDH1A1
Hydrochloric Acid SCHEMBL2285638 0.96 MMP2 (0.61) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL28508112 0.96 MMP2 (0.61) MMP2G6PDCASP7CASP6ALDH1A1
SCHEMBL26108766 0.96 MMP2 (0.61) MMP2G6PDCASP7CASP6ALDH1A1
Hydrochloric Acid SCHEMBL28051606 0.94 MMP2 (0.59) MMP2G6PDCASP7CASP6ALDH1A1

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-102503876-A Bisamide derivative, preparation method for same and application thereof UNIV NANKAI 2012-06-20 CN disclosed
JP-2000128825-A PRODUCTION OF BIPHENYLTETRACARBOXYLIC ACID JSR CORP 2000-05-09 JP disclosed