SCHEMBL8777620

SCHEMBL8777620

Cc1cc(Cc2ccc(N(Cc3c(-c4ccccc4)n(C)c4ccccc34)c3ccc(N(C)C)cc3)c(C)c2)ccc1N(Cc1c(-c2ccccc2)n(C)c2ccccc12)c1ccc(N(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.42
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
PPARG P37231 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 2/20 0.35
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
GFER P55789 1/20 0.35
ATM Q13315 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34

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
SCHEMBL8777566 0.89 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDFNTAFNTB
SCHEMBL8777579 0.87 ALDH1A1 (0.49) ALDH1A1HSD17B10HPGDFNTAFNTB
SCHEMBL11478641 0.71 ALDH1A1 (0.63) ALDH1A1HSD17B10HPGDFNTAFNTB
SCHEMBL31558739 0.68 ALDH1A1 (0.46) ALDH1A1HSD17B10HPGDLMNANPC1
SCHEMBL10652634 0.64 ALDH1A1 (0.69) ALDH1A1HSD17B10HPGDFNTAFNTB
SCHEMBL18351210 0.63 ALDH1A1 (0.45) ALDH1A1HSD17B10HPGDLMNANPC1
SCHEMBL8777785 0.63 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDMEN1KMT2A
SCHEMBL8777589 0.63 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDLMNANPC1
SCHEMBL31744703 0.63 ALDH1A1 (0.51) ALDH1A1HSD17B10HPGDPPARGMEN1
SCHEMBL8777532 0.63 ALDH1A1 (0.38) ALDH1A1HSD17B10HPGDLMNANPC1

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 2 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
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed