SCHEMBL31580931

SCHEMBL31580931

OB(O)c1cc(Cl)cc(OCc2cccc(Cl)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.56
▸ MAOB P27338 8/20 0.54
▸ RXRA P19793 1/20 0.52
▸ RXRB P28702 1/20 0.52
▸ RXRG P48443 1/20 0.52
▸ MRGPRX4 Q96LA9 1/20 0.52
▸ MAOA P21397 5/20 0.51
▸ NR4A2 P43354 1/20 0.51
▸ GRM5 P41594 1/20 0.48
▸ PKM P14618 1/20 0.47
▸ ALOX5 P09917 1/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ IDO1 P14902 1/20 0.46
▸ AGXT P21549 1/20 0.46

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
SCHEMBL29778401 0.88 MRGPRX4 (0.51) ENPP2MAOBRXRARXRBRXRG
SCHEMBL21408 0.87 NR4A2 (0.59) ENPP2MAOBRXRARXRBRXRG
SCHEMBL2563261 0.85 MAOB (0.65) ENPP2MAOBRXRARXRBRXRG
SCHEMBL2560312 0.85 MRGPRX4 (0.58) ENPP2MAOBRXRARXRBRXRG
SCHEMBL31580896 0.85 MAOB (0.65) ENPP2MAOBRXRARXRBRXRG
SCHEMBL15330536 0.84 NR4A2 (0.56) ENPP2MAOBRXRARXRBRXRG
SCHEMBL31051000 0.84 NR4A2 (0.56) ENPP2MAOBRXRARXRBRXRG
SCHEMBL2557883 0.79 RXRA (0.62) ENPP2MAOBRXRARXRBRXRG
SCHEMBL257956 0.78 MAOB (0.59) ENPP2MAOBRXRARXRBRXRG
SCHEMBL257845 0.78 ENPP2 (0.62) ENPP2MAOBRXRARXRBRXRG

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-2025104079-A1 SALICYLIC ACID AND PICOLINIC ACID DERIVATIVES AS INHIBITORS OF ENERGY COUPLING FACTOR (ECF) TRANSPORTERS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2025-05-22 — — WO disclosed
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