Formic Acid

Formic Acid

SCHEMBL5562317

CN1C[C@@H]2C[C@H]1CN2C(=O)c1n[nH]c2cc(C3=CCOCC3)ccc12.O=CO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.43
▸ JAK2 O60674 2/20 0.36
▸ JAK1 P23458 2/20 0.36
▸ TYK2 P29597 2/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ USP30 Q70CQ3 1/20 0.35
▸ IDH1 O75874 3/20 0.35
▸ BRD4 O60885 1/20 0.34
▸ PAK1 Q13153 2/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ DYRK1A Q13627 3/20 0.32
▸ SCN9A Q15858 1/20 0.32
▸ WNT1 P04628 2/20 0.32
▸ KRAS P01116 1/20 0.31
▸ IKBKE Q14164 1/20 0.31
▸ TBK1 Q9UHD2 1/20 0.31

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
SCHEMBL1176284 0.97 GSK3B (0.45) GSK3BJAK2JAK1TYK2JAK3
SCHEMBL5043690 0.97 GSK3B (0.45) GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5556898 0.93 GSK3B (0.50) GSK3BDYRK1AWNT1
SCHEMBL1176422 0.90 GSK3B (0.53) GSK3BDYRK1AWNT1
SCHEMBL5043498 0.90 GSK3B (0.53) GSK3BDYRK1AWNT1
Formic Acid SCHEMBL5563265 0.82 GSK3B (0.46) GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5563052 0.82 JAK2 (0.36) GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5556316 0.81 CDK2 (0.46) GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5563840 0.81 JAK2 (0.36) GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5561750 0.80 BRD4 (0.37) JAK2JAK1TYK2JAK3USP30

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-1697378-B1 INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF MEMORY PHARM CORP (US) 2007-11-21 — — EP claimed
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