SCHEMBL9982485

SCHEMBL9982485

CC(=O)Nc1ccc(C)cc1N1CCC(n2c(N)nc3ccccc32)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.46
▸ OPRK1 P41145 7/20 0.46
▸ OGFRL1 Q5TC84 7/20 0.46
▸ OPRD1 P41143 6/20 0.46
▸ LMNA P02545 2/20 0.45
▸ ALPI P09923 1/20 0.44
▸ BRD4 O60885 1/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ UBE2N P61088 1/20 0.42
▸ OPRL1 P41146 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NOD1 Q9Y239 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL9982871 0.76 KMT2A (0.43) LMNAMAPK1MEN1KMT2ANPC1
SCHEMBL9982481 0.76 DHFR (0.44) OPRM1OPRK1OGFRL1OPRD1NPSR1
SCHEMBL12598295 0.75 BRD4 (0.63) OPRM1OPRK1OGFRL1OPRD1LMNA
SCHEMBL14827783 0.73 THRB (0.42) OPRM1OPRK1OGFRL1OPRD1LMNA
SCHEMBL9982909 0.73 GAA (0.43) LMNANPSR1MAPK1MEN1KMT2A
SCHEMBL12067255 0.72 C5AR1 (0.49) OPRM1OPRK1OPRD1LMNAOPRL1
SCHEMBL8792880 0.72 POLB (0.52) LMNANPSR1MAPK1MEN1KMT2A
SCHEMBL14826124 0.71 OGFRL1 (0.47) OPRM1OPRK1OGFRL1OPRD1LMNA
SCHEMBL8630899 0.71 OPRM1 (0.49) OPRM1OPRK1OGFRL1OPRD1OPRL1
SCHEMBL9982687 0.70 OPRM1 (0.60) OPRM1OPRK1OGFRL1OPRD1LMNA

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 6 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
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 OPRM1 956/4885OPRK1 610/4885OGFRL1 172/4885

“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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