SCHEMBL4750362

SCHEMBL4750362

CCCN(CCC)S(=O)(=O)c1ccc(/C=C(/C)C(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.52
SMN1; SMN2 Q16637 5/20 0.52
RAB9A P51151 3/20 0.52
KDM4E B2RXH2 4/20 0.51
MAPK1 P28482 4/20 0.51
USP2 O75604 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
MAPT P10636 5/20 0.50
GSTO1 P78417 1/20 0.48
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 2/20 0.47
TP53 P04637 1/20 0.47
KCNQ1 P51787 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47

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
SCHEMBL4750368 1.00 LMNA (0.52) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4750364 1.00 LMNA (0.52) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747496 0.87 LMNA (0.55) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747498 0.87 LMNA (0.55) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747503 0.87 LMNA (0.55) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747486 0.85 PARP1 (0.58) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747484 0.85 PARP1 (0.58) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4747488 0.85 PARP1 (0.58) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4749602 0.84 KDM4E (0.72) LMNASMN1; SMN2RAB9AKDM4EMAPK1
SCHEMBL4749582 0.84 KDM4E (0.72) LMNASMN1; SMN2RAB9AKDM4EMAPK1

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-2008124000-A2 THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2008-10-16 WO claimed
WO-2008124000-A2 THIAZOLE DERIVATIVES AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2008-10-16 WO disclosed