SCHEMBL8777656

SCHEMBL8777656

COC(c1ccc(N(C)C)cc1)c1c(C)n(C)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.38
ALDH1A1 P00352 5/20 0.38
RAB9A P51151 4/20 0.38
KDM4E B2RXH2 4/20 0.38
HTT P42858 3/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
TP53 P04637 2/20 0.38
PKM P14618 1/20 0.38
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MGAM O43451 3/20 0.37
SI P14410 3/20 0.37
MGAM2 Q2M2H8 3/20 0.37
GLA P06280 1/20 0.35
CYP2C19 P33261 1/20 0.35
GPR3 P46089 1/20 0.35

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
SCHEMBL10836556 0.87 GAA (0.39) GAAALDH1A1RAB9AKDM4EHTT
SCHEMBL10836562 0.84 NPC1 (0.37) GAAALDH1A1RAB9AKDM4EHTT
SCHEMBL8777650 0.84 ALDH1A1 (0.40) ALDH1A1RAB9AKDM4EHTTHPGD
SCHEMBL8777790 0.84 CYP19A1 (0.43) GAAALDH1A1RAB9AKDM4EHTT
SCHEMBL8777753 0.81 CNR2 (0.42) ALDH1A1KDM4EHTTNPSR1
SCHEMBL8777573 0.81 ALDH1A1 (0.45) GAAALDH1A1KDM4EMAPTPKM
SCHEMBL10834697 0.81 ALDH1A1 (0.35) GAAALDH1A1RAB9AKDM4EHPGD
SCHEMBL8777654 0.80 ALDH1A1 (0.42) GAAALDH1A1RAB9AKDM4EHTT
SCHEMBL8777617 0.75 ALDH1A1 (0.38) GAAALDH1A1RAB9AKDM4EHTT
SCHEMBL8777589 0.74 ALDH1A1 (0.41) ALDH1A1RAB9AKDM4EHTTHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587184-B1 Pressure sensitive recording materials NEW OJI PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5478793-A Basic dye-containing layer and color accetpor-containing layer formed on same or different surfaces; basic dye enclosed in synthetic polymer microcapsules, color acceptor is activated clay containing silica KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-12-26 US disclosed
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed