SCHEMBL5945786

SCHEMBL5945786

COC(=O)c1nn(-c2ccc(C(N)=O)cc2)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.62
ELANE P08246 5/20 0.55
PLAU P00749 3/20 0.55
F2 P00734 2/20 0.55
RORC P51449 4/20 0.49
ALDH1A1 P00352 3/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HPGD P15428 1/20 0.44
TP53 P04637 1/20 0.44
FGFR1 P11362 1/20 0.42
RARG P13631 1/20 0.42

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
SCHEMBL14333217 0.87 SCN9A (0.57) SCN9AELANEPLAUF2RORC
SCHEMBL717998 0.86 ELANE (0.63) SCN9AELANEPLAUF2RORC
SCHEMBL16260376 0.85 SCN9A (0.56) SCN9AELANEPLAUF2RORC
SCHEMBL4790822 0.84 SCN9A (0.55) SCN9AELANEPLAUF2RORC
SCHEMBL14406104 0.83 SCN9A (0.54) SCN9AELANEPLAUF2RORC
SCHEMBL6136810 0.83 ALDH1A1 (0.54) SCN9ARORCALDH1A1HPGDFGFR1
SCHEMBL14406063 0.82 SCN9A (0.53) SCN9AELANEPLAUF2RORC
SCHEMBL14333720 0.81 ELANE (0.54) SCN9AELANEPLAUF2ALDH1A1
SCHEMBL4791726 0.81 SCN9A (0.55) SCN9AELANEPLAUF2RORC
SCHEMBL4795077 0.80 SCN9A (0.57) SCN9AELANEPLAUF2RORC

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
US-20060135589-A1 1h-Indazole-3-carboxamide compounds as cyclin dependent kinase (cdk) inhibitors ASTEX TECHNOLOGY, INC. (GB) 2006-06-22 US disclosed
EP-1534685-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS Astex Technology Limited (GB) 2005-06-01 EP disclosed
WO-2005014554-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS MAPKAP KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2005-02-17 WO disclosed
WO-2004014864-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-02-19 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-20060135589-A1 1h-Indazole-3-carboxamide compounds as cyclin dependent kinase (cdk) inhibitors CCNC, CDK1, CDK7 SCN9A 1836/4885ELANE 4267/4885PLAU 4377/4885

“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.