SCHEMBL14833192

SCHEMBL14833192

CCCc1nnc(-c2ccc(F)cc2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
KDM4E B2RXH2 3/20 0.43
QPCTL Q9NXS2 3/20 0.41
QPCT Q16769 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
DCK P27707 1/20 0.40
NPC1 O15118 2/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 1/20 0.39
SREBF2 Q12772 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL10271445 0.86 KDM4E (0.48) RAB9AKDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL9702829 0.84 RAB9A (0.51) RAB9AKDM4EQPCTLQPCTSMN1; SMN2
SCHEMBL9704789 0.84 RAB9A (0.47) RAB9AKDM4EQPCTLQPCTSMN1; SMN2
SCHEMBL9704064 0.81 RAB9A (0.49) RAB9AKDM4EQPCTLQPCTSMN1; SMN2
SCHEMBL9702907 0.80 ALDH1A1 (0.57) RAB9AKDM4EQPCTLSMN1; SMN2KMT2A
SCHEMBL10058752 0.79 QPCTL (0.40) RAB9AKDM4EQPCTLQPCTSMN1; SMN2
SCHEMBL9702474 0.79 RAB9A (0.63) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL9702773 0.79 RAB9A (0.66) RAB9AKDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL25416550 0.79 HDAC1 (0.40) RAB9AKDM4EQPCTLQPCTSMN1; SMN2
SCHEMBL10058947 0.79 RAB9A (0.61) RAB9AKDM4ESMN1; SMN2KMT2AMEN1

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
EP-2760833-A1 PYRIDINE DERIVATIVES Endo Pharmaceuticals Inc. (US) 2014-08-06 EP disclosed
WO-2013049559-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2013-04-04 WO disclosed