SCHEMBL8570694

SCHEMBL8570694

O=C1Nc2ccccc2C(c2ccccc2)N1C1CCN(Cc2ccccn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.49
TRPV6 Q9H1D0 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SIGMAR1 Q99720 2/20 0.43
PRKCG P05129 2/20 0.43
PRKCB P05771 2/20 0.43
PRKCA P17252 2/20 0.43
PRKCE Q02156 2/20 0.43
PIP5K1C O60331 1/20 0.43
RPS6KA5 O75582 1/20 0.43
RPS6KA4 O75676 1/20 0.43
STK16 O75716 1/20 0.43
PAK3 O75914 1/20 0.43
CDK14 O94921 1/20 0.43
MET P08581 1/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
PIM1 P11309 1/20 0.43

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
SCHEMBL29445321 0.86 OPRL1 (0.52) OPRM1OPRK1OPRL1CYP2C19KMT2A
SCHEMBL6168606 0.86 OPRL1 (0.52) OPRM1OPRK1OPRL1CYP2C19KMT2A
SCHEMBL8565096 0.85 CCR5 (0.48) TRPV6SIGMAR1OPRL1CHRM2CHRM3
SCHEMBL8573015 0.84 PARP1 (0.51) PARP1KDM4EPRKG1OPRL1ALDH1A1
SCHEMBL8569508 0.82 MEN1 (0.53) SIGMAR1OPRM1OPRL1KMT2ACXCR3
SCHEMBL8570739 0.82 CHRM2 (0.54) TRPV6KDM4ESIGMAR1GSK3BOPRM1
SCHEMBL8564971 0.81 TACR1 (0.43) PRKCGPRKCBPRKCAPRKCEPRKCH
SCHEMBL8565287 0.81 CHRM3 (0.53) SIGMAR1OPRM1KMT2AALDH1A1CHRM1
SCHEMBL6168284 0.81 TACR1 (0.41) KDM4ESMN1; SMN2OPRM1OPRL1KMT2A
SCHEMBL6168102 0.80 CHRM3 (0.42) PARP1PRKCGPRKCBPRKCAPRKCE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626373-B1 Quinazolinone derivatives SUMITOMO PHARMA (JP) 1998-12-23 EP disclosed
US-5556860-A ANTIISCHEMIC AGENTS, BRAIN DISORDERS AND BLOOD METAL CONCENTRATIONS AND KIDNEY DISEASE SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1996-09-17 US disclosed
EP-0626373-A1 Quinazolinone derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-30 EP disclosed