Formic Acid

Formic Acid

SCHEMBL2591954

NC(=O)c1ncc(C(F)(F)F)cc1F.O=CO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
KMT2A Q03164 5/20 0.49
USP2 O75604 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.44
GAA P10253 3/20 0.43
HPGD P15428 2/20 0.43
GLA P06280 1/20 0.43
PLAU P00749 1/20 0.41
MEN1 O00255 2/20 0.41
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL6033804 0.94 KMT2A (0.53) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL1719092 0.79 ALDH1A1 (0.73) ALDH1A1KMT2AMAPTLMNAGAA
SCHEMBL29827991 0.79 ALDH1A1 (0.73) ALDH1A1KMT2AMAPTLMNAGAA
SCHEMBL1499037 0.78 GLA (0.49) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL9928605 0.77 MAPT (0.47) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL14861898 0.77 CFTR (0.55) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL15922616 0.77 SMN1; SMN2 (0.53) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL30134211 0.77 MAPT (0.47) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT
SCHEMBL18412886 0.73 PKM (0.52) ALDH1A1KMT2ASMN1; SMN2MAPTKDM4E
SCHEMBL22208505 0.73 MAPK1 (0.47) ALDH1A1KMT2AUSP2SMN1; SMN2MAPT

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
WO-2011138293-A1 2,5,6,7-TETRAHYDRO-[1,4]OXAZEPIN-3-YLAMINE OR 2,3,6,7-TETRAHYDRO-[1,4]OXAZEPIN-5-YLAMINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2011-11-10 WO disclosed