Formic Acid

Formic Acid

SCHEMBL30097166

CC(C)c1nc(NCc2ccc(B(O)O)cc2)c2[nH]ncc2n1.O=CO

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 2/20 0.32
CXCR2 P25025 2/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL27409392 0.95 CCNB2 (0.34) CXCR1CXCR2HDAC6HSD17B10CCNB2
Formic Acid SCHEMBL29985120 0.85 ENPP1 (0.38) HDAC6HSD17B10CCNB2CDK1CCNB1
Formic Acid SCHEMBL27244260 0.85 ENPP1 (0.38) HDAC6HSD17B10CCNB2CDK1CCNB1
SCHEMBL27244249 0.79 HDAC6 (0.32) HDAC6
SCHEMBL27244284 0.75 KDM4E (0.33) HDAC6HSD17B10CCNB2CDK1CCNB1
SCHEMBL27409396 0.74 PDE5A (0.49) HSD17B10PDE4APDE4BPDE4CPDE4D
SCHEMBL27409249 0.73 LMNA (0.44) CXCR1CXCR2CCNB2CDK1CCNB1
SCHEMBL27409147 0.72 PDE2A (0.36) CXCR1CXCR2PDE4APDE4BPDE4C
SCHEMBL27409993 0.66 HDAC6 (0.40) CXCR1CXCR2HDAC6
SCHEMBL21332784 0.62 CCNE2 (0.51) CCNB2CDK1CCNB1CCNB3

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
US-20240209005-A1 BICYCLIC HETEROARYL BORONATE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC 2024-06-27 US disclosed
WO-2022197734-A1 BICYCLIC HETEROARYL BORONATE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2022-09-22 WO 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-20240209005-A1 BICYCLIC HETEROARYL BORONATE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS ENPP1, ENPP3, ENTPD5 CXCR1 2685/4885CXCR2 2938/4885HDAC6 1347/4885

“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.