SCHEMBL7467939

SCHEMBL7467939

O=C(O)c1ccc(Cl)cc1NCc1cccnc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.59
KDM4C Q9H3R0 4/20 0.58
KDM4E B2RXH2 3/20 0.58
KDM6B O15054 1/20 0.58
KDM4A O75164 1/20 0.58
KDM4D Q6B0I6 1/20 0.58
HTT P42858 2/20 0.55
LMNA P02545 1/20 0.55
CDK5 Q00535 1/20 0.55
CDK5R1 Q15078 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
GAA P10253 1/20 0.54
USP2 O75604 1/20 0.52
ACLY P53396 1/20 0.52
POLB P06746 2/20 0.51
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL9688887 0.85 ACLY (0.64) GRIK1KDM4CKDM4EKDM6BKDM4A
SCHEMBL7464371 0.84 MEN1 (0.59) GRIK1KDM4CKDM4EKDM6BKDM4A
SCHEMBL22071204 0.79 KDM4C (0.53) GRIK1KDM4CKDM4EKDM6BSMN1; SMN2
SCHEMBL10557452 0.78 POLB (0.66) KDM4EHTTLMNACDK5CDK5R1
SCHEMBL30611270 0.77 GRIK1 (0.74) GRIK1LMNAUSP2POLBALDH1A1
SCHEMBL29110322 0.77 GRIK1 (0.74) GRIK1LMNAUSP2POLBALDH1A1
SCHEMBL2382365 0.76 USP2 (0.58) KDM4CKDM4EKDM6BKDM4AKDM4D
SCHEMBL913752 0.76 CDK5 (0.62) KDM4ECDK5CDK5R1SMN1; SMN2GAA
SCHEMBL10556274 0.76 ALDH1A1 (0.71) KDM4EPOLBALDH1A1
SCHEMBL15817727 0.76 KDM4C (0.76) KDM4CKDM4EKDM6BKDM4AKDM4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
US-5814631-A CHYMASE INHIBITOR, CARDIVASCULAR SUNTORY LIMITED (JP) 1998-09-29 US disclosed
US-5783698-A REACTING HALOFORMATE FUNCTIONALIZED POLYSTYRENE WITH SUBSTITUTED ANTHRANILIC ACID DERIVATIVE TO FORM URETHANE LINKAGE, REACTING THE INTERMEDIATE WITH PRIMARY AMINE TO FORM ANTHRANILAMIDES, HEATING, CYCLIZATION, LIBERATING END PRODUCT MERCK SHARP & DOHME LIMITED (GB) 1998-07-21 US disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed