SCHEMBL9307984

SCHEMBL9307984

CC(C)(CO)c1cc(C(N)=O)ccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM5C P41229 2/20 0.40
KDM5B Q9UGL1 2/20 0.40
KDM4B O94953 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MKNK1 Q9BUB5 2/20 0.37
MKNK2 Q9HBH9 2/20 0.37
MYC P01106 1/20 0.37
KDM5A P29375 1/20 0.36
KDM5D Q9BY66 1/20 0.36
KDM4C Q9H3R0 1/20 0.36

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
SCHEMBL22169023 0.87 ALDH1A1 (0.44) LMNASMN1; SMN2HTTNPC1RAB9A
SCHEMBL11347447 0.83 LMNA (0.56) LMNASMN1; SMN2HTTNPC1RAB9A
SCHEMBL17526117 0.81 LMNA (0.44) LMNASMN1; SMN2HTTNPC1RAB9A
SCHEMBL28738078 0.81 KDM4E (0.51) LMNASMN1; SMN2HTTNPC1RAB9A
SCHEMBL20008492 0.80 LMNA (0.43) LMNASMN1; SMN2HTTNPC1RAB9A
SCHEMBL20008477 0.76 MYC (0.46) LMNASMN1; SMN2NPC1RAB9AKDM5C
SCHEMBL4043325 0.76 LOXL2 (0.49) KDM5CKDM5BKDM4BMKNK1MKNK2
SCHEMBL29427234 0.76 LOXL2 (0.49) KDM5CKDM5BKDM4BMKNK1MKNK2
Hydrochloric Acid SCHEMBL28122952 0.75 LOXL2 (0.50) KDM5CKDM5BKDM4B
SCHEMBL20909893 0.74 UHRF1 (0.43) LMNASMN1; SMN2NPC1RAB9AALDH1A1

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-5369084-A Isonicotinic acid derivatives and related spiro compounds with herbicidal action JANSSEN PHARMACEUTICAL N.V. (BE) 1994-11-29 US disclosed
WO-1992009577-A1 ISONICOTINIC ACID DERIVATIVES AND RELATED SPIRO COMPOUNDS WITH HERBICIDAL ACTION JANSSEN PHARMACEUTICA N.V. (BE) 1992-06-11 WO disclosed