Formic Acid

Formic Acid

SCHEMBL25172108

N#CCOc1ccc(-c2cnc3c(Nc4ccc(C(=O)N5CCN(C(=O)N6CCN[C@H](CO)C6)CC5)c(Cl)c4)nccn23)c(F)c1F.O=CO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 20/20 0.50
▸ LCK P06239 7/20 0.39
▸ AURKB Q96GD4 4/20 0.39

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
Formic Acid SCHEMBL30171804 1.00 PTK6 (0.50) PTK6LCKAURKB
SCHEMBL22124897 0.98 PTK6 (0.52) PTK6LCKAURKB
SCHEMBL22125462 0.98 PTK6 (0.52) PTK6LCKAURKB
SCHEMBL22142700 0.98 PTK6 (0.52) PTK6LCKAURKB
SCHEMBL30193144 0.98 PTK6 (0.52) PTK6LCKAURKB
SCHEMBL24910546 0.93 PTK6 (0.53) PTK6LCKAURKB
SCHEMBL22125164 0.91 PTK6 (0.51) PTK6LCKAURKB
SCHEMBL30202044 0.91 PTK6 (0.51) PTK6LCKAURKB
SCHEMBL22125203 0.91 PTK6 (0.51) PTK6LCKAURKB
SCHEMBL24977845 0.91 PTK6 (0.51) PTK6LCKAURKB

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
EP-3898630-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-05-10 — — EP disclosed
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