Formic Acid

Formic Acid

SCHEMBL27693263

O=C(NC1CCC1)c1ccc2ccccc2c1OCc1ccccc1.O=CO

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 2/20 0.57
SGMS2 Q8NHU3 1/20 0.56
CNR2 P34972 6/20 0.52
CNR1 P21554 5/20 0.52
MAOB P27338 1/20 0.50
IDH1 O75874 1/20 0.49
DRD4 P21917 3/20 0.47
CXCR2 P25025 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NR1I2 O75469 1/20 0.44
HPGD P15428 1/20 0.44
AHR P35869 1/20 0.44
HTT P42858 1/20 0.44

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 SCHEMBL27712959 0.92 CNR2 (0.56) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27693230 0.92 DRD4 (0.52) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27713047 0.89 CXCR2 (0.58) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27693432 0.88 CXCR2 (0.46) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27693239 0.87 CXCR2 (0.47) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27712967 0.85 KMT2A (0.55) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27713038 0.85 PIN1 (0.42) MEN1KMT2AALDH1A1SGMS2CNR2
Formic Acid SCHEMBL27693208 0.85 ALOX5AP (0.51) KMT2AALDH1A1CNR2CNR1RAB9A
Formic Acid SCHEMBL28770786 0.84 CHRM1 (0.46) MEN1KMT2AALDH1A1SGMS2CNR2
SCHEMBL485699 0.84 CXCR2 (0.62) MEN1KMT2AALDH1A1SGMS2CNR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101094830-A Fused bicyclic carboxamide derivatives for use as CXCR2 inhibitors in the treatment of inflammation SANOFI AVENTIS DEUTSCHLAND (DE) 2007-12-26 CN claimed
CN-101094830-A Fused bicyclic carboxamide derivatives for use as CXCR2 inhibitors in the treatment of inflammation SANOFI AVENTIS DEUTSCHLAND (DE) 2007-12-26 CN disclosed