SCHEMBL8007477

SCHEMBL8007477

CC(C)(C)c1ccc(-c2cn3nc(N)nc3nc2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.42
RAB9A P51151 7/20 0.42
KDM4E B2RXH2 6/20 0.39
JAK2 O60674 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
DGAT1 O75907 2/20 0.38
MAP4K4 O95819 1/20 0.37
PAK4 O96013 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 1/20 0.37
GRK5 P34947 1/20 0.37
MAPK8 P45983 1/20 0.37
CSNK1A1 P48729 1/20 0.37
ACVR1 Q04771 1/20 0.37
PTK2 Q05397 1/20 0.37
TYRO3 Q06418 1/20 0.37
MAP4K2 Q12851 1/20 0.37
DYRK1A Q13627 1/20 0.37

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
SCHEMBL8003726 0.86 JAK2 (0.53) KDM4EJAK2MAP4K4PAK4CSF1R
SCHEMBL8009410 0.85 KDM4E (0.43) NPC1RAB9AKDM4EJAK2SMN1; SMN2
SCHEMBL8012335 0.81 MAP4K4 (0.55) NPC1RAB9AKDM4EJAK2SMN1; SMN2
SCHEMBL7997517 0.75 KDM4E (0.52) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL8013138 0.75 F2RL3 (0.38) NPC1RAB9AKDM4EJAK2TP53
SCHEMBL8912927 0.70 KDM4E (0.45) NPC1RAB9AKDM4ESMN1; SMN2TP53
SCHEMBL8009917 0.68 KDM4E (0.43) NPC1RAB9AKDM4EJAK2SMN1; SMN2
SCHEMBL2968149 0.64 HPGD (0.41) NPC1RAB9AKDM4ESMN1; SMN2TP53
SCHEMBL5471370 0.63 NPC1 (0.54) NPC1RAB9ASMN1; SMN2TP53LMNA
SCHEMBL3705440 0.61 AKT1 (0.47) NPC1RAB9AJAK2SMN1; SMN2PTK2

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-2000009508-A1 TRIAZOLOPYRIMIDINE DERIVATIVES NIHON BAYER AGROCHEM K.K. (DE) 2000-02-24 WO disclosed