SCHEMBL14977258

SCHEMBL14977258

CCC(NC(=O)c1ccc2c(c1)ncn2Cc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 1.00
▸ CYP1A2 P05177 1/20 0.68
▸ CYP3A4 P08684 1/20 0.68
▸ CYP2D6 P10635 1/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68

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
SCHEMBL15992392 1.00 PPARG (1.00) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15992288 1.00 PPARG (1.00) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4539858 0.94 PPARG (0.89) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4540388 0.93 PPARG (0.87) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15992198 0.92 PPARG (0.86) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL16731516 0.92 PPARG (0.86) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL16000001 0.92 PPARG (0.86) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL16000000 0.92 PPARG (0.86) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15991920 0.91 PPARG (0.84) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15991921 0.91 PPARG (0.84) PPARGCYP1A2CYP3A4CYP2D6CYP2C9

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-20140249196-A1 N-BENZYLBENZIMIDAZOLE MODULATORS OF PPARG SCRIPPS RESEARCH INSTITUTE, THE 2014-09-04 — — US disclosed
US-20140249196-A1 N-BENZYLBENZIMIDAZOLE MODULATORS OF PPARG SCRIPPS RESEARCH INSTITUTE, THE 2014-09-04 — — US disclosed
US-20140249196-A1 N-BENZYLBENZIMIDAZOLE MODULATORS OF PPARG SCRIPPS RESEARCH INSTITUTE, THE 2014-09-04 — — US disclosed
WO-2013078233-A1 N-BENZYLBENZIMIDAZOLE MODULATORS OF PPARG RIPKA AMY S (US) 2013-05-30 — — 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-20140249196-A1 N-BENZYLBENZIMIDAZOLE MODULATORS OF PPARG PPARG, CDK5, CDK5R1 PPARG 1/4885CYP1A2 3318/4885CYP3A4 1376/4885

“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.

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