SCHEMBL5166388

SCHEMBL5166388

O=C(O)c1cccc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
ALOX15 P16050 1/20 0.47
HNF4A P41235 1/20 0.46
KDM4E B2RXH2 3/20 0.44
HPGD P15428 3/20 0.44
ALB P02768 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MMP2 P08253 1/20 0.44
PARP1 P09874 1/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 1/20 0.41
HMGB1 P09429 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41

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
SCHEMBL31267556 0.84 ALB (0.41) ALDH1A1KDM4EHPGDALBHSD17B10
Salicylic Acid SCHEMBL20923488 0.82 ALDH1A1 (0.58) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL6745009 0.80 TSHR (0.44) ALDH1A1KDM4EHPGDHSD17B10PARP1
SCHEMBL31361778 0.80 TSHR (0.44) ALDH1A1KDM4EHPGDHSD17B10PARP1
SCHEMBL9868485 0.80 NPC1 (0.46) ALDH1A1KDM4EHPGDHSD17B10CYP2C9
SCHEMBL22618507 0.79 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMMP2CYP3A4
SCHEMBL7699953 0.77 NPC1 (0.47) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL31437603 0.77 RAB9A (0.51) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL29031120 0.77 RAB9A (0.51) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL17296033 0.75 NPC1 (0.51) ALDH1A1HNF4AKDM4EHPGDHSD17B10

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-1086978-B1 ADDITIVE-CONTAINING MOLDED RESIN AND PROCESS FOR PRODUCING THE SAME TAKIRON CO (JP) 2007-04-11 EP disclosed
US-6569531-B1 Adding multifunctional additive to thermoplastic polyester resin, allowing to react with molecules of resin which is in molten state, molding to produce additive-containing resin molded article TAKIRON CO., LTD. (JP) 2003-05-27 US disclosed
EP-1086978-A1 ADDITIVE-CONTAINING MOLDED RESIN AND PROCESS FOR PRODUCING THE SAME Takiron Co., Ltd. (JP) 2001-03-28 EP disclosed