SCHEMBL22441541

SCHEMBL22441541

C/C(CC(C)C)=N/NC(=O)c1cccc(C(=O)N/N=C(\C)CC(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.55
FURIN P09958 1/20 0.54
OGG1 O15527 2/20 0.53
GAA P10253 3/20 0.53
KMT2A Q03164 3/20 0.53
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 5/20 0.52
MAPT P10636 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
MTOR P42345 4/20 0.50
PKM P14618 1/20 0.48
ALDH1A1 P00352 5/20 0.47
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
HPGD P15428 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL6635616 1.00 RAB9A (0.55) RAB9AFURINOGG1GAAKMT2A
SCHEMBL30826094 0.91 MAPT (0.57) RAB9AOGG1GAAKMT2AKDM4E
SCHEMBL27177972 0.91 MAPT (0.57) RAB9AOGG1GAAKMT2AKDM4E
SCHEMBL27177978 0.91 MAPT (0.57) RAB9AOGG1GAAKMT2AKDM4E
SCHEMBL1562807 0.89 SMN1; SMN2 (0.65) RAB9AKMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL6637074 0.89 SMN1; SMN2 (0.65) RAB9AKMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1562806 0.89 SMN1; SMN2 (0.65) RAB9AKMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1563371 0.84 MAPT (0.58) RAB9AGAAKMT2AKDM4EMAPT
SCHEMBL1563372 0.84 MAPT (0.58) RAB9AGAAKMT2AKDM4EMAPT
SCHEMBL6635696 0.84 MAPT (0.58) RAB9AGAAKMT2AKDM4EMAPT

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
EP-3725838-A1 RUBBER COMPOSITION FOR TIRE TREAD AND TIRE Bridgestone Corporation (JP) 2020-10-21 EP disclosed
US-20200299490-A1 RUBBER COMPOSITION FOR TIRE TREAD AND TIRE BRIDGESTONE CORPORATION (JP) 2020-09-24 US disclosed