SCHEMBL10885672

SCHEMBL10885672

Cc1cc(C)[nH]n1.Cc1ccn(C)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
RAB9A P51151 4/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 3/20 0.33
KMT2A Q03164 1/20 0.33
PIM1 P11309 1/20 0.33
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
DAO P14920 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
NTRK1 P04629 2/20 0.32
JMJD6 Q6NYC1 1/20 0.32
PDE10A Q9Y233 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KEAP1 Q14145 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL75314 0.79
Hydrochloric Acid SCHEMBL27901405 0.77
SCHEMBL1503 0.77
SCHEMBL30404482 0.75
SCHEMBL29150915 0.75
SCHEMBL28852463 0.75 HCAR2 (0.44) L3MBTL1RAB9AKDM4EGAASMN1; SMN2
SCHEMBL28959328 0.75 HCAR2 (0.44) L3MBTL1RAB9AKDM4EGAASMN1; SMN2
Potassium SCHEMBL30471622 0.75
SCHEMBL30802139 0.75
SCHEMBL28054863 0.75

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
EP-0054837-B1 LIQUID CRYSTAL COMPOSITIONS WITH TRIS-AZO DICHROIC DYES GENERAL ELECTRIC COMPANY (US) 1986-04-02 EP claimed