SCHEMBL9982900

SCHEMBL9982900

CC(=O)Nc1ccc(Cl)cc1N1CCC(n2c(=N)n(Cc3cccc4[nH]ccc34)c3ccccc32)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GOT1 P17174 5/20 0.41
▸ C5AR1 P21730 7/20 0.41
▸ OPRM1 P35372 4/20 0.38
▸ OPRL1 P41146 2/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ GAA P10253 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ HTR1A P08908 1/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ ABCB11 O95342 1/20 0.34
▸ BRD2 P25440 1/20 0.34
▸ BRD3 Q15059 1/20 0.34
▸ BRDT Q58F21 1/20 0.34

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
SCHEMBL9982697 0.92 GOT1 (0.39) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12069834 0.92 OPRM1 (0.38) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12069193 0.91 OPRM1 (0.42) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL14814879 0.90 GOT1 (0.38) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL14814877 0.90 GOT1 (0.38) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12069192 0.90 DRD2 (0.40) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12067252 0.89 TRPV1 (0.42) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12067251 0.89 GOT1 (0.39) GOT1C5AR1OPRM1OPRL1OPRK1
SCHEMBL12067691 0.87 C5AR1 (0.47) C5AR1OPRM1MAPT
SCHEMBL9982729 0.85 C5AR1 (0.41) C5AR1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582681-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES Novartis AG (CH) 2013-04-24 — — EP disclosed
US-20130085161-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-04 — — US disclosed
US-20130085161-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-04 — — US disclosed
WO-2011157793-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 — — WO disclosed
WO-2011157793-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 — — 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-20130085161-A1 PIPERIDINYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES IGF1R, IGFBP1, IGFBP2 GOT1 539/4885C5AR1 1212/4885OPRM1 956/4885

“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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