SCHEMBL8533988

SCHEMBL8533988

COc1ccc(N(C(=O)c2ccccc2)c2ccccc2)cc1N(S)C(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 2/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
FABP4 P15090 1/20 0.37
TSHR P16473 1/20 0.37
MAPKAPK2 P49137 1/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK14 Q16539 1/20 0.36
CNR2 P34972 1/20 0.35
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
ATM Q13315 1/20 0.34
PDE4D Q08499 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6812711 0.82 PNLIP (0.49) MEN1KMT2ARAB9AMAPK14ALDH1A1
SCHEMBL6813192 0.80 MEN1 (0.52) MEN1KMT2ATSHRLMNAMAPT
SCHEMBL8533982 0.79 KMT2A (0.53) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL6812369 0.79 MEN1 (0.54) MEN1KMT2ATSHRLMNAMAPT
SCHEMBL6813784 0.76 RAB9A (0.44) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL6812404 0.75 CA12 (0.53) MEN1KMT2AFABP4TSHRLMNA
SCHEMBL6809708 0.74 HDAC8 (0.53) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL6813269 0.73 NPC1 (0.51) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL6813289 0.73 HDAC8 (0.56) MEN1KMT2ATSHRMAPTRAB9A
SCHEMBL6813608 0.73 HDAC8 (0.48) MEN1KMT2ATSHRMAPTRAB9A

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-1042276-A1 THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY LLC (US) 2000-10-11 EP disclosed
WO-1999032433-A1 THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO disclosed