SCHEMBL10017013

SCHEMBL10017013

Cc1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccnc(-c6ccccc6)c5)c5ccccc45)c4ccccc34)ccc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 2/20 0.36
PRKDC P78527 1/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTRC Q99895 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 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
SCHEMBL10017233 0.85 DHODH (0.41) TGFBR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10016893 0.85 CYP1A2 (0.38) TGFBR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10017007 0.85 MAPT (0.41) TGFBR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL9613105 0.84 TGFBR1 (0.44) TGFBR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10017352 0.83 BTK (0.42) TGFBR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10017350 0.82 MAPT (0.47) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10017019 0.81 MEN1 (0.41) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10016998 0.81 MAPT (0.43) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10032684 0.81 CYP2A6 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10017201 0.81 MAPT (0.46) MEN1KMT2AKDM4EALDH1A1MAPT

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
WO-2012005214-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME JNC株式会社 (JP) 2012-01-12 WO disclosed