SCHEMBL7260633

SCHEMBL7260633

CCc1nnc(-c2ccc(N)cc2)o1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.64
RAB9A P51151 8/20 0.64
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
KDM4E B2RXH2 6/20 0.55
HSD17B10 Q99714 5/20 0.55
ALDH1A1 P00352 5/20 0.55
HPGD P15428 5/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
MAPT P10636 4/20 0.55
GLA P06280 1/20 0.55
ALOX15 P16050 1/20 0.55
TP53 P04637 3/20 0.54
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
POLB P06746 2/20 0.50
NOTUM Q6P988 2/20 0.49
TSHR P16473 2/20 0.49
USP2 O75604 1/20 0.49

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
SCHEMBL156353 0.83 KMT2A (0.59) NPC1RAB9AKMT2AKDM4EHSD17B10
SCHEMBL4788167 0.83 NPC1 (0.56) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL23106548 0.82 NOTUM (0.49) NPC1RAB9AKMT2AALDH1A1HPGD
SCHEMBL15377081 0.82 NPC1 (0.60) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL3032013 0.81 MAPT (0.49) NPC1RAB9AKMT2AKDM4EHSD17B10
SCHEMBL13572955 0.81 TSHR (0.73) NPC1RAB9AKDM4EHSD17B10HPGD
SCHEMBL8589773 0.81 NPC1 (0.61) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL14438048 0.81 KMT2A (0.62) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL8050653 0.81 PTGS2 (0.52) NPC1RAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL8235977 0.81 ALDH1A1 (0.67) NPC1RAB9AKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003016293-A1 OXADIAZOLYL AND THIADIAZOLYL BENZOYL UREAS AND THE USE THEREOF AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-02-27 WO disclosed