SCHEMBL978245

SCHEMBL978245

Nc1cccc(-c2cnc3ccccc3c2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.66
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
CYP2A6 P11509 1/20 0.58
MAP4K4 O95819 5/20 0.58
MKNK2 Q9HBH9 2/20 0.57
CSNK1G2 P78368 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57
MAP4K5 Q9Y4K4 1/20 0.57
PDGFRB P09619 2/20 0.57
PDGFRA P16234 2/20 0.57
PIK3CD O00329 2/20 0.55
PIK3CA P42336 2/20 0.55
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
MAOA P21397 1/20 0.52
PIK3CB P42338 1/20 0.51
MTOR P42345 1/20 0.51

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
SCHEMBL27631118 0.87 BIRC5 (0.77) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL30323720 0.87 BIRC5 (0.77) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL22709526 0.86 PDGFRB (0.61) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL2772360 0.83 PDGFRB (0.77) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL32667946 0.83 PDGFRB (0.77) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL19943005 0.82 PDGFRB (0.66) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL30722842 0.82 PDGFRB (0.66) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL708999 0.81 PDGFRB (0.75) BIRC5NPC1RAB9ACYP2A6MAP4K4
SCHEMBL29818168 0.80 PDGFRB (0.62) BIRC5CYP2A6MAP4K4MKNK2CSNK1G2
SCHEMBL24621829 0.80 PDGFRB (0.72) BIRC5NPC1RAB9ACYP2A6MAP4K4

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12358869-B2 Diarylureas as CB1 allosteric modulators RESEARCH TRIANGLE INSTITUTE 2025-07-15 US disclosed
US-20210332007-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS RESEARCH TRIANGLE INSTITUTE 2021-10-28 US disclosed
US-11084781-B2 Diarylureas as CB1 allosteric modulators RESEARCH TRIANGLE INSTITUTE (US) 2021-08-10 US disclosed
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
EP-3621951-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS Research Triangle Institute (US) 2020-03-18 EP disclosed
US-20200062699-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-02-27 US disclosed
WO-2018209030-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS RTI INTERNATIONAL (US) 2018-11-15 WO disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 US disclosed
US-9802937-B2 Substituted pyrazolo{4,3-D}pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-10-31 US disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
US-20110021522-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-01-27 US disclosed
EP-2237784-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 The Regents of the University of California (US) 2010-10-13 EP disclosed
WO-2009089508-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-07-16 WO disclosed
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 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 (10 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-12358869-B2 Diarylureas as CB1 allosteric modulators CNR1, CNR2, GPR18 BIRC5 3121/4885NPC1 1047/4885RAB9A 857/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK BIRC5 1864/4885NPC1 4398/4885RAB9A 872/4885
US-11084781-B2 Diarylureas as CB1 allosteric modulators CNR1, CNR2, GPR18 BIRC5 3121/4885NPC1 1047/4885RAB9A 857/4885
US-20200062699-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS CNR1, CNR2, GPR18 BIRC5 3121/4885NPC1 1047/4885RAB9A 857/4885
US-20110021522-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 CASP7, CASP3, CASP6 BIRC5 50/4885NPC1 2565/4885RAB9A 3095/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 BIRC5 1482/4885NPC1 4130/4885RAB9A 621/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK BIRC5 1648/4885NPC1 4434/4885RAB9A 860/4885
US-20210332007-A1 DIARYLUREAS AS CB1 ALLOSTERIC MODULATORS CNR1, CNR2, GPR18 BIRC5 3121/4885NPC1 1047/4885RAB9A 857/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK BIRC5 1648/4885NPC1 4434/4885RAB9A 860/4885
US-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 BIRC5 4636/4885NPC1 875/4885RAB9A 1092/4885

“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.