SCHEMBL11656339

SCHEMBL11656339

Cc1ccc(NC(=O)/N=N/C(=O)Nc2ccc(C)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.61
POLB P06746 2/20 0.59
NPC1 O15118 4/20 0.57
RAB9A P51151 3/20 0.57
KIF11 P52732 1/20 0.53
TGM2 P21980 1/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPT P10636 3/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NMT1 P30419 1/20 0.50
DDAH1 O94760 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PKM P14618 1/20 0.48

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
SCHEMBL8660127 1.00 TDP1 (0.61) TDP1POLBNPC1RAB9AKIF11
SCHEMBL11182821 0.81 TDP1 (0.55) TDP1POLBNPC1RAB9AKIF11
SCHEMBL27562010 0.81 TDP1 (0.55) TDP1POLBNPC1RAB9AKIF11
SCHEMBL28044354 0.79 TDP1 (0.53) TDP1POLBNPC1RAB9AKIF11
SCHEMBL455439 0.78 TDP1 (0.70) TDP1POLBNPC1RAB9AKIF11
SCHEMBL6850999 0.78 KDM4E (0.79) TDP1POLBNPC1RAB9AKIF11
SCHEMBL1275920 0.78 ALDH1A1 (0.70) TDP1POLBNPC1RAB9AKDM4E
SCHEMBL61417 0.76 TDP1 (1.00) TDP1POLBNPC1RAB9AKDM4E
SCHEMBL11650361 0.76 EPHX2 (0.61) TGM2MAPTSMN1; SMN2ALDH1A1
Fluoride SCHEMBL11790965 0.76 TDP1 (0.67) TDP1POLBNPC1RAB9AKIF11

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-4104301-A BLOWING AGENTS ARMSTRONG CORK COMPANY (US) 1978-08-01 US disclosed