Formic Acid

Formic Acid

SCHEMBL5561750

CN1C[C@@H]2C[C@H]1CN2C(=O)c1n[nH]c2cc(-c3ncco3)ccc12.O=CO

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.37
▸ JAK2 O60674 2/20 0.35
▸ JAK1 P23458 2/20 0.35
▸ TYK2 P29597 2/20 0.35
▸ JAK3 P52333 2/20 0.35
▸ MTOR P42345 2/20 0.34
▸ USP30 Q70CQ3 1/20 0.34
▸ LTA4H P09960 1/20 0.33
▸ VNN1 O95497 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ CHRNA7 P36544 4/20 0.33
▸ KCNH2 Q12809 4/20 0.33
▸ SMO Q99835 1/20 0.33
▸ PAK1 Q13153 1/20 0.32
▸ CPT1A P50416 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL5044455 0.96 BRD4 (0.39) BRD4JAK2JAK1TYK2JAK3
SCHEMBL1176212 0.96 BRD4 (0.39) BRD4JAK2JAK1TYK2JAK3
SCHEMBL5563184 0.89 DYRK1A (0.40) BRD4MTORCHRNA7KCNH2LRRK2
SCHEMBL2105493 0.86 BRD4 (0.39) BRD4JAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5556316 0.85 CDK2 (0.46) JAK2JAK1TYK2JAK3USP30
Formic Acid SCHEMBL5563265 0.84 GSK3B (0.46) JAK2JAK1TYK2JAK3USP30
Formic Acid SCHEMBL5562752 0.83 CHEK1 (0.38) JAK2JAK1TYK2JAK3USP30
Formic Acid SCHEMBL5563052 0.82 JAK2 (0.36) JAK2JAK1TYK2JAK3USP30
Formic Acid SCHEMBL5563840 0.81 JAK2 (0.36) JAK2JAK1TYK2JAK3MTOR
SCHEMBL1176625 0.81 CDK2 (0.48) 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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