SCHEMBL14765232

SCHEMBL14765232

CCCCCc1cn(CCCCC)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.54
CYP2C19 P33261 3/20 0.54
KMT2A Q03164 3/20 0.54
CYP2C9 P11712 2/20 0.54
GAA P10253 1/20 0.54
MEN1 O00255 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
MAPT P10636 1/20 0.44
GPR84 Q9NQS5 13/20 0.44
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39
TK1 P04183 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
SCHEMBL7686410 0.97 CYP1A2 (0.54) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7679685 0.97 KMT2A (0.50) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7681735 0.91 KMT2A (0.48) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7675267 0.88 CYP1A2 (0.44) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7685334 0.81 HTT (0.43) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7681871 0.81 HTT (0.50) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7681977 0.81 CYP1A2 (0.40) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7679806 0.80 CYP2C19 (0.40) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7684492 0.79 CYP1A2 (0.38) CYP1A2CYP2C19KMT2ACYP2C9GAA
SCHEMBL7677782 0.79 DAO (0.56) KMT2AGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889874-B2 Imidazolone-chalcone derivatives as potential anticancer agent and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-11-18 US disclosed
EP-2523941-B1 IMIDAZOLONE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENT AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2014-10-15 EP disclosed
US-20130066081-A1 IMIDAZOLONE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENT AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2013-03-14 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-20130066081-A1 IMIDAZOLONE-CHALCONE DERIVATIVES AS POTENTIAL ANTICANCER AGENT AND PROCESS FOR THE PREPARATION THEREOF SIK1, SIK2, SIK3 CYP1A2 619/4885CYP2C19 229/4885KMT2A 3057/4885

“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.