SCHEMBL15867014

SCHEMBL15867014

CC(C)c1cnc(-n2ccc(C(C)C)n2)nc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.32
CASR P41180 1/20 0.31
GRIA1 P42261 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
SCHEMBL889374 0.79 GRIA1 (0.43) NOTUMGRIA1
SCHEMBL19105578 0.71 OPRM1 (0.40)
SCHEMBL12205781 0.69 GRIA1 (0.36) GRIA1
SCHEMBL24927470 0.69 ELANE (0.36) NOTUMCASR
SCHEMBL2609420 0.68 CASR (0.48) CASR
SCHEMBL23368132 0.68 ELOVL1 (0.39) CASRGRIA1
SCHEMBL18782798 0.67 GRIA1 (0.39) CASRGRIA1
SCHEMBL23176116 0.67 CASR (0.40) NOTUMCASR
SCHEMBL15980624 0.67 NOTUM (0.44) NOTUMCASR
SCHEMBL15980636 0.67 GRIA1 (0.51) GRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-07-10 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-20140193363-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 NOTUM 1717/4885CASR 4817/4885GRIA1 4371/4885

“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.