SCHEMBL11525111

SCHEMBL11525111

Cc1ccc(Cc2ncc(NC(=O)NC(=O)c3c(C)cccc3C)nc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
RAB9A P51151 8/20 0.36
NPC1 O15118 6/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 4/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 2/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
GAA P10253 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGAV P06756 1/20 0.35
ITGA5 P08648 1/20 0.35
GBA1 P04062 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL11524161 0.82 RAB9A (0.39) ATMRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL11523355 0.81 TYK2 (0.37) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL11525157 0.80 MAPT (0.48) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL11372439 0.75 ALDH1A1 (0.43) L3MBTL1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL11523668 0.74 PIK3CA (0.43) RAB9ANPC1KMT2AKDM4EMAPK1
SCHEMBL11524059 0.72 TRPV1 (0.42) ATMRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL11526201 0.72 TYK2 (0.45) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL11373899 0.71 NPC1 (0.45) L3MBTL1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL11523346 0.70 RAB9A (0.40) ATML3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL11521578 0.69 KDM4E (0.38) ATMRAB9ANPC1SMN1; SMN2MEN1

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
US-4160834-A INSECTICIDES ELI LILLY AND COMPANY (US) 1979-07-10 US disclosed
US-4083977-A Novel insecticidal 1-(substituted benzoyl)-3-(substituted pyrazinyl)ureas ELI LILLY AND COMPANY (US) 1978-04-11 US disclosed