SCHEMBL7670178

SCHEMBL7670178

CC(c1ccccc1)c1cc(C(N)=O)c(NC(=O)c2nccc3ccccc23)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 4/20 0.41
KDM4E B2RXH2 5/20 0.40
FLT3 P36888 1/20 0.39
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
NPC1 O15118 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK10 P53779 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL7666511 0.84 MAPT (0.51) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7666491 0.83 MAPT (0.43) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7666427 0.81 MAPT (0.41) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7676538 0.80 PARP1 (0.49) MAPTMEN1KMT2ATP53RAB9A
SCHEMBL5093025 0.79 IKBKB (0.57) MAPTMEN1KMT2AKDM4EMAPK1
SCHEMBL7674466 0.78 HDAC1 (0.53) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7666423 0.78 RAB9A (0.48) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7675355 0.78 KDR (0.44) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL7670423 0.78 RAB9A (0.49) MAPTMEN1KMT2ATP53RAB9A
SCHEMBL7670759 0.77 OPRM1 (0.47) MAPTRAB9AKDM4E

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
US-6414013-B1 KINASE INHIBITORS; ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-07-02 US claimed