SCHEMBL31359391

SCHEMBL31359391

Cc1ccc(C(=O)O)cc1OCc1cncc(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.51
▸ RXRA P19793 2/20 0.48
▸ RXRB P28702 2/20 0.48
▸ RXRG P48443 2/20 0.48
▸ MRGPRX4 Q96LA9 9/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.44
▸ HCAR2 Q8TDS4 1/20 0.44
▸ PPARA Q07869 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ XDH P47989 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
SCHEMBL31364809 0.88 PKM (0.52) PKMSMN1; SMN2POLBMAPTHTT
SCHEMBL23501616 0.88 PKM (0.52) PKMSMN1; SMN2POLBMAPTHTT
SCHEMBL29933845 0.88 PKM (0.52) PKMSMN1; SMN2POLBMAPTHTT
SCHEMBL28884716 0.82 RXRA (0.48) RXRARXRBRXRGMRGPRX4XDH
SCHEMBL29934080 0.82 RXRA (0.48) RXRARXRBRXRGMRGPRX4XDH
SCHEMBL29934013 0.80 SMPD1 (0.50) RXRARXRBRXRGMRGPRX4
SCHEMBL28884599 0.80 SMPD1 (0.50) RXRARXRBRXRGMRGPRX4
SCHEMBL69666 0.78 RXRA (0.70) RXRARXRBRXRGMRGPRX4SMN1; SMN2
SCHEMBL22169881 0.78 RXRA (0.55) RXRARXRBRXRGMRGPRX4XDH
SCHEMBL23501607 0.75 HDAC8 (0.53) PKMSMN1; SMN2POLBHCAR2

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
CN-119371371-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2025-01-28 — — CN disclosed
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