SCHEMBL13495154

SCHEMBL13495154

Oc1cc(-c2ccccc2)nn1-c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
KDM4E B2RXH2 2/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
GRM5 P41594 3/20 0.56
MAPT P10636 5/20 0.53
CCNA2 P20248 1/20 0.53
CDK2 P24941 1/20 0.53
HSD17B10 Q99714 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
MCL1 Q07820 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PTPN1 P18031 1/20 0.51
LMNA P02545 4/20 0.49
L3MBTL1 Q9Y468 2/20 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
SCHEMBL23401834 0.88 ALDH1A1 (0.64) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL7406578 0.87 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL16330805 0.83 SMN1; SMN2 (0.60) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL31420284 0.81 SMN1; SMN2 (0.54) SMN1; SMN2KDM4ENPC1RAB9AGRM5
SCHEMBL25433738 0.80 MAPT (0.50) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL14133117 0.80 ALDH1A1 (0.48) SMN1; SMN2MEN1KMT2AKDM4ERAB9A
SCHEMBL22445661 0.79 KMT2A (0.56) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL6369452 0.79 MEN1 (0.68) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL28610606 0.78 SMN1; SMN2 (0.55) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL23400150 0.78 CA1 (0.52) SMN1; SMN2MEN1KMT2AKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010015657-A2 NEW ALKOXYPYRAZOLES INSTITUT PASTEUR (FR) 2010-02-11 WO disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed