Formic Acid

Formic Acid

SCHEMBL2680174

Nc1cc(N2CCNC(=O)CC2)nc2c(-c3cnc4ccccc4c3)cnn12.O=CO

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.38
PARP11 Q9NR21 1/20 0.38
PIK3CA P42336 4/20 0.36
PIM1 P11309 2/20 0.35
PIM2 Q9P1W9 2/20 0.35
MAPK1 P28482 2/20 0.35
PLK4 O00444 1/20 0.35
DAPK3 O43293 1/20 0.35
DYRK3 O43781 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
CHEK2 O96017 1/20 0.35
CDK1 P06493 1/20 0.35
RPS6KB1 P23443 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
CLK2 P49760 1/20 0.35

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
SCHEMBL2680935 0.96 PARP10 (0.41) PARP10PARP11PIK3CAPIM1PIM2
SCHEMBL10280214 0.81 PARP10 (0.40) PARP10PARP11PIK3CAPIM1PIM2
SCHEMBL2679803 0.80 PARP10 (0.39) PARP10PARP11PIK3CAPIM1PIM2
SCHEMBL30736 0.78 ATR (0.49) PIK3CAMAPK1ATRATRIPKDM4E
SCHEMBL6894351 0.78 PARP10 (0.37) PARP10PARP11PIK3CAPIM1PIM2
SCHEMBL6891509 0.77 NEK2 (0.42) PIK3CAMAPK1KDM4EMEN1NPC1
SCHEMBL6894450 0.76 CRBN (0.42) PIK3CAMAPK1ATRATRIPKDM4E
SCHEMBL6893434 0.75 FASN (0.40) PIK3CAMAPK1ATRATRIPKDM4E
SCHEMBL6893511 0.75 EGFR (0.38) PIK3CAMAPK1KDM4EMEN1NPC1
SCHEMBL10238869 0.75 CKS1B (0.48) PIK3CAMAP4K4PDE10A

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-8591943-B2 Pyrazolo[1,5-a]pyrimidine derivatives as mTOR inhibitors MERCK SHARP & DOHME CORP. (US) 2013-11-26 US disclosed
US-20120114739-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS MERCK SHARP & DOHME LLC 2012-05-10 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-20120114739-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS MTOR, RICTOR, RPTOR PARP10 760/4885PARP11 495/4885PIK3CA 34/4885

“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.