Formic Acid

Formic Acid

SCHEMBL9339307

Cc1ccc(C(=O)NCCC(=O)O)cc1NC(=O)[C@@H](N)CCCNC(=N)N.O=CO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 1/20 0.43
▸ ITGB3 P05106 3/20 0.39
▸ ITGAV P06756 1/20 0.39
▸ LNPEP Q9UIQ6 5/20 0.39
▸ ERAP2 Q6P179 4/20 0.39
▸ POLB P06746 1/20 0.37
▸ TERT O14746 4/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ ITGA2B P08514 2/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 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
SCHEMBL9335895 0.96 CASR (0.43) CASRITGB3ITGAVLNPEPERAP2
Formic Acid SCHEMBL9335859 0.89 POLB (0.48) CASRLNPEPERAP2POLB
SCHEMBL9337573 0.84 POLB (0.52) LNPEPERAP2POLBHTT
Formic Acid SCHEMBL9339344 0.83 EPHX2 (0.44) CASRITGB3ITGA2B
SCHEMBL9335939 0.79 HDAC3 (0.39) ITGB3LNPEPERAP2HDAC3ITGA2B
SCHEMBL9335651 0.79 EPHX2 (0.47) CASRITGB3ITGA2B
SCHEMBL9337587 0.75 HPGD (0.40) ITGB3LNPEPERAP2POLBHDAC3
SCHEMBL9866523 0.73 HTT (0.49) CASRITGB3ITGAVPOLBHDAC3
SCHEMBL177287 0.72 CASR (0.62) CASRLNPEPERAP2
SCHEMBL177286 0.72 CASR (0.62) CASRLNPEPERAP2

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
EP-0372486-B1 Benzoic-acid phenylacetic-acid derivatives, their preparation and their use as medicines HOFFMANN LA ROCHE (CH) 1994-06-01 — — EP claimed
US-5039805-A Novel benzoic and phenylacetic acid derivatives HOFFMANN-LA ROCHE INC. (US) 1991-08-13 — — US disclosed
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