SCHEMBL8777566

SCHEMBL8777566

CN(C)c1ccc(N(Cc2c(-c3ccccc3)n(C)c3ccccc23)c2ccc(Cc3ccc(N(Cc4c(-c5ccccc5)n(C)c5ccccc45)c4ccc(N(C)C)cc4)c(Cl)c3)cc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
PPARG P37231 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 3/20 0.35
NPC1 O15118 2/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 3/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.33

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
SCHEMBL8777620 0.89 ALDH1A1 (0.42) ALDH1A1HPGDHSD17B10FNTAFNTB
SCHEMBL8777579 0.86 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10FNTAFNTB
SCHEMBL11478641 0.70 ALDH1A1 (0.63) ALDH1A1HPGDHSD17B10FNTAFNTB
SCHEMBL31558739 0.65 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10MAPTNPC1
SCHEMBL10652634 0.64 ALDH1A1 (0.69) ALDH1A1HPGDHSD17B10FNTAFNTB
SCHEMBL18351210 0.62 ALDH1A1 (0.45) ALDH1A1HPGDHSD17B10MAPTNPC1
SCHEMBL8777785 0.62 ALDH1A1 (0.57) ALDH1A1HPGDHSD17B10MEN1KMT2A
SCHEMBL8777589 0.62 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10MAPTNPC1
SCHEMBL31744703 0.62 ALDH1A1 (0.51) ALDH1A1HPGDHSD17B10PPARGMEN1
SCHEMBL8777532 0.62 ALDH1A1 (0.38) ALDH1A1HPGDHSD17B10MAPTNPC1

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