SCHEMBL7007522

SCHEMBL7007522

Brc1ccnc2c(Br)cncc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.39
AXL P30530 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSP90AA1 P07900 2/20 0.36
KDM4E B2RXH2 2/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CCR1 P32246 1/20 0.32

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
SCHEMBL2206337 0.74 CCR1 (0.50) PRKCIMEN1KMT2AHSP90AA1KDM4E
SCHEMBL28083103 0.70 KDM4E (0.41) PRKCIAXLMEN1KMT2AHSP90AA1
SCHEMBL3577754 0.70 AXL (0.47) PRKCIAXL
SCHEMBL20296322 0.68 MAPK1 (0.35) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL31509775 0.68 LMNA (0.48) MEN1KMT2AHSP90AA1KDM4EAPAF1
SCHEMBL112474 0.68 LMNA (0.48) MEN1KMT2AHSP90AA1KDM4EAPAF1
SCHEMBL29191973 0.67 AXL (0.36) AXL
SCHEMBL25323059 0.67 AXL (0.48) AXLMEN1KMT2AHSP90AA1APAF1
SCHEMBL30551090 0.67 AXL (0.48) AXLMEN1KMT2AHSP90AA1APAF1
SCHEMBL1463005 0.67 PDE4A (0.35) KMT2AALDH1A1SMN1; SMN2

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
EP-1075478-B1 PHENYLUREA AND PHENYLTHIO UREA DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2003-04-16 EP claimed