SCHEMBL8777650

SCHEMBL8777650

COC(c1ccc(N(C)C)cc1)c1c(-c2ccccc2)n(C)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
LMNA P02545 2/20 0.40
HSD17B10 Q99714 3/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
GFER P55789 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA3 P34903 1/20 0.38

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
SCHEMBL8777589 0.91 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777602 0.87 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777664 0.87 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777570 0.85 ALDH1A1 (0.38) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777532 0.85 ALDH1A1 (0.38) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL18351210 0.85 ALDH1A1 (0.45) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777656 0.84 GAA (0.38) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777663 0.83 CNR2 (0.38) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777643 0.82 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2
SCHEMBL8777775 0.75 VDR (0.43) ALDH1A1LMNAHSD17B10CYP2C19SMN1; SMN2

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