SCHEMBL30317341

SCHEMBL30317341

CCC1CCCc2c1c1cccc(C(=O)O)c1n2Cc1cccc(C(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 17/20 0.60
▸ FABP3 P05413 2/20 0.53
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ HTR6 P50406 1/20 0.44

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
SCHEMBL28983452 1.00 FABP4 (0.60) FABP4FABP3CYP2D6CYP2C9HIF1A
SCHEMBL30317503 0.95 FABP4 (0.67) FABP4FABP3HTR6
SCHEMBL28983430 0.95 FABP4 (0.67) FABP4FABP3HTR6
SCHEMBL30317332 0.93 FABP4 (0.69) FABP4FABP3
SCHEMBL28983477 0.88 FABP4 (0.65) FABP4FABP3HTR6
SCHEMBL30317283 0.88 FABP4 (0.65) FABP4FABP3HTR6
SCHEMBL28983444 0.86 FABP4 (0.63) FABP4FABP3HTR6
SCHEMBL28983437 0.86 FABP4 (0.62) FABP4FABP3HTR6
SCHEMBL30317536 0.84 FABP4 (0.57) FABP4FABP3
SCHEMBL28983470 0.84 FABP4 (0.57) FABP4FABP3

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761598-A Antiviral use of FABP4 modulating compounds 新月生物科学 2023-09-15 — — CN claimed
EP-4175647-A1 ANTIVIRAL USE OF FABP4 MODULATING COMPOUNDS Crescenta Biosciences (US) 2023-05-10 — — EP claimed
EP-4171736-A1 NOVEL CELL METABOLISM MODULATING COMPOUNDS AND USES THEREOF Crescenta Biosciences (US) 2023-05-03 — — EP claimed
CN-115803085-A Novel cell metabolism regulating compounds and uses 新月生物科学 2023-03-14 — — CN claimed
CN-116761598-A Antiviral use of FABP4 modulating compounds 新月生物科学 2023-09-15 — — CN disclosed
EP-4175647-A1 ANTIVIRAL USE OF FABP4 MODULATING COMPOUNDS Crescenta Biosciences (US) 2023-05-10 — — EP disclosed
EP-4171736-A1 NOVEL CELL METABOLISM MODULATING COMPOUNDS AND USES THEREOF Crescenta Biosciences (US) 2023-05-03 — — EP disclosed
CN-115803085-A Novel cell metabolism regulating compounds and uses 新月生物科学 2023-03-14 — — CN disclosed
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