SCHEMBL2645861

SCHEMBL2645861

CC(=O)N1CCCCC1c1cc(N)ccc1Oc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 11/20 0.50
▸ KMT2A Q03164 2/20 0.42
▸ CCNT1 O60563 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ OPRM1 P35372 4/20 0.38
▸ OPRD1 P41143 4/20 0.38
▸ OPRK1 P41145 4/20 0.38
▸ TRPC6 Q9Y210 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
SCHEMBL2645785 0.82 GCK (0.48) GCKKMT2AMEN1
SCHEMBL1922688 0.78 GCK (0.47) GCK
SCHEMBL1922687 0.78 GCK (0.47) GCK
SCHEMBL17273929 0.78 GCK (0.56) GCKTRPC6
SCHEMBL17273931 0.78 GCK (0.56) GCKTRPC6
SCHEMBL2645563 0.74 GCK (0.44) GCKKMT2AOPRM1OPRD1OPRK1
SCHEMBL2645354 0.72 GPR119 (0.48) GCKKMT2AMEN1
SCHEMBL2644674 0.71 GCK (0.95) GCK
SCHEMBL17454945 0.69 CCNC (0.52) —
SCHEMBL3312815 0.65 SMN1; SMN2 (0.48) —

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
EP-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 — — EP disclosed
US-7728025-B2 2-heteroaryl-substituted benzimidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 — — US disclosed
US-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative MSD K.K. (JP) 2008-03-20 — — US disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 — — EP 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-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative GCK, GCKR, HK1 GCK 1/4885KMT2A 1946/4885CCNT1 1881/4885

“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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