Formic Acid

Formic Acid

SCHEMBL3899780

CC(=O)NC1(c2cccc(C(F)(F)F)c2)CCNCC1.O=CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.44
CCR2 P41597 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
TACR1 P25103 3/20 0.42
TACR3 P29371 2/20 0.42
FPR1 P21462 1/20 0.41
FPR2 P25090 1/20 0.41
LMNA P02545 1/20 0.41
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2C19 P33261 1/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
OPRM1 P35372 2/20 0.39
OPRL1 P41146 1/20 0.39
SCN9A Q15858 1/20 0.38

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
SCHEMBL5168073 0.95 CCR2 (0.46) BACE1CCR2HDAC3HDAC1HDAC2
Formic Acid SCHEMBL3894178 0.84 ALDH1A1 (0.54) BACE1HDAC3HDAC1HDAC2HDAC6
SCHEMBL3899787 0.80 TACR1 (0.43) BACE1CCR2HDAC3HDAC1HDAC2
SCHEMBL5170508 0.79 ALDH1A1 (0.58) BACE1HDAC3HDAC1HDAC2HDAC6
Formic Acid SCHEMBL3898641 0.78 CYP2C19 (0.41) HDAC3HDAC1HDAC2HDAC6TACR3
SCHEMBL2932067 0.78 ALDH1A1 (0.51) CCR2HDAC3HDAC1HDAC2HDAC6
SCHEMBL19280073 0.76 ALDH1A1 (0.41) BACE1HDAC1SLC6A4SLC6A3ALDH1A1
SCHEMBL28650686 0.76 HDAC3 (0.51) CCR2HDAC3HDAC1HDAC2HDAC6
SCHEMBL23654370 0.76 HDAC3 (0.53) CCR2HDAC3HDAC1HDAC2HDAC6
Formic Acid SCHEMBL3895033 0.75 PDE2A (0.47) SLC6A4SLC6A3ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101006084-B 4-arylmorpholin-3-one derivatives, preparation method and therapeutic use thereof SANOFI AVENTIS 2010-09-08 CN disclosed
US-7521449-B2 4-arylmorpholin-3-one derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-04-21 US disclosed
CN-101006084-A 4-arylmorpholin-3-one derivatives, preparation method and therapeutic use thereof SANOFI AVENTIS (FR) 2007-07-25 CN disclosed
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF ADRB3, ADRA2C, OPRK1 BACE1 1083/4885CCR2 246/4885HDAC3 378/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.