Formic Acid

Formic Acid

SCHEMBL25174774

Cc1cc(Nc2nccn3c(-c4ccc(OCC#N)c(F)c4Cl)cnc23)ccc1C(=O)N1CCN(C(=O)[C@@H]2C[C@@H](O)CN2)CC1.O=CO

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 19/20 0.40
▸ LCK P06239 6/20 0.34
▸ AURKB Q96GD4 5/20 0.33
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32

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 SCHEMBL30171791 1.00 PTK6 (0.40) PTK6LCKAURKBJAK2JAK1
SCHEMBL30177633 0.98 PTK6 (0.42) PTK6LCKAURKBJAK2JAK1
SCHEMBL22124449 0.98 PTK6 (0.42) PTK6LCKAURKBJAK2JAK1
Formic Acid SCHEMBL25174741 0.95 PTK6 (0.39) PTK6LCKAURKBJAK2JAK1
Formic Acid SCHEMBL22123814 0.94 PTK6 (0.47) PTK6LCKAURKB
SCHEMBL30177896 0.93 PTK6 (0.42) PTK6LCKAURKBJAK2JAK1
SCHEMBL22155092 0.93 PTK6 (0.40) PTK6LCKAURKBJAK2JAK1
SCHEMBL22124513 0.93 PTK6 (0.40) PTK6LCKAURKBJAK2JAK1
SCHEMBL22139101 0.93 PTK6 (0.40) PTK6LCKAURKBJAK2JAK1
SCHEMBL25174773 0.92 PTK6 (0.40) PTK6LCKAURKBJAK2JAK1

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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