SCHEMBL28215465

SCHEMBL28215465

Clc1cc(Cl)cc(OCc2ccccn2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SYK P43405 4/20 0.53
PARP10 Q53GL7 1/20 0.50
PDE10A Q9Y233 1/20 0.47
SLC6A4 P31645 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX5 P09917 1/20 0.46
ALOX5AP P20292 1/20 0.46
FFAR1 O14842 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.45

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
SCHEMBL4856658 0.89 SYK (0.53) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL17712563 0.84 SMN1; SMN2 (0.63) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL28049606 0.79 SYK (0.57) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL156401 0.79 SYK (0.50) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL6445371 0.79 KCNH2 (0.67) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL28153213 0.79 KDM4E (0.53) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL24089573 0.78 SYK (0.49) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL24089571 0.78 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL26580976 0.77 KDM4E (0.51) SMN1; SMN2KDM4EALDH1A1SYKPARP10
SCHEMBL9719821 0.77 SYK (0.58) SMN1; SMN2KDM4EALDH1A1SYKPARP10

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
CN-105263490-B Substituted triazolopyridines and methods of use 基因泰克公司 2018-05-22 CN disclosed