SCHEMBL1367313

SCHEMBL1367313

O=C(Nc1nc2ncccc2[nH]1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.65
NPC1 O15118 11/20 0.65
RAB9A P51151 11/20 0.65
PKM P14618 5/20 0.65
MAOB P27338 3/20 0.65
ADORA2A P29274 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
ADORA2B P29275 1/20 0.61
ADORA1 P30542 1/20 0.61
SCD O00767 1/20 0.59
KLF5 Q13887 2/20 0.52
OPRK1 P41145 1/20 0.52
KDM4E B2RXH2 1/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KDR P35968 2/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL861789 0.85 HPSE (0.52) PRMT5NPC1RAB9APKMMAOB
SCHEMBL29066590 0.81 LMNA (0.60) PRMT5KDM4EKMT2A
SCHEMBL4405834 0.81 NPC1 (0.58) PRMT5NPC1RAB9APKMMAOB
SCHEMBL4316866 0.80 ALDH1A1 (0.67) PRMT5NPC1RAB9APKMSMN1; SMN2
SCHEMBL6244081 0.79 PRMT5 (1.00) PRMT5NPC1RAB9AKDRMEN1
SCHEMBL3926899 0.79 NPC1 (1.00) NPC1RAB9APKMMAOBADORA2A
SCHEMBL12807020 0.77 HPSE (0.48) PRMT5TP53KMT2AMAPT
SCHEMBL27593194 0.77 ALDH1A1 (0.49) PRMT5SMN1; SMN2KDM4EKMT2A
SCHEMBL11703118 0.76 MAOB (0.71) NPC1RAB9APKMMAOBADORA2A
SCHEMBL6118295 0.76 MAOB (0.71) NPC1RAB9APKMMAOBADORA2A

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
US-8207340-B2 Imidazopyridinyl benzamide mitotic kinesin inhibitors CYTOKINETICS, INCORPORATED (US) 2012-06-26 US disclosed
US-8163919-B2 Imidazopyridinyl benzamide mitotic kinesin inhibitors CYTOKINETICS, INCORPORATED (US) 2012-04-24 US disclosed
US-8067599-B2 Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors HOFFMAN-LA ROCHE INC. (US) 2011-11-29 US disclosed
US-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS HOFFMANN-LA ROCHE, INC. 2009-12-24 US disclosed
EP-2064213-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2009-06-03 EP disclosed
WO-2008028617-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-13 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-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS MAP3K5, MAP3K1, PRKACA PRMT5 573/4885NPC1 1424/4885RAB9A 991/4885

“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.