SCHEMBL9750061

SCHEMBL9750061

CN(C)c1ccc(C(=CC(C=C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)c2ccc3ccccc3c2C(N)=O)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.42
IDO1 P14902 1/20 0.41
MAPT P10636 6/20 0.39
ALDH1A1 P00352 5/20 0.38
GAA P10253 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
POLB P06746 2/20 0.38
RAB9A P51151 4/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 3/20 0.38
NPC1 O15118 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM1A O60341 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NOX1 Q9Y5S8 1/20 0.37
TP53 P04637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL9839395 0.93 MAOB (0.40) CNR2IDO1MAPTPOLBRAB9A
SCHEMBL9750427 0.88 MAPT (0.42) CNR2IDO1MAPTALDH1A1RAB9A
SCHEMBL9749664 0.88 KMT2A (0.41) CNR2MAPTALDH1A1GAARAB9A
SCHEMBL9749968 0.78 MAPT (0.47) MAPTALDH1A1TDP1POLBRAB9A
SCHEMBL9749975 0.73 ALDH1A1 (0.47) MAPTALDH1A1GAATDP1POLB
SCHEMBL9750036 0.72 MAPT (0.44) MAPTALDH1A1GAATDP1POLB
SCHEMBL9750076 0.71 ALDH1A1 (0.41) MAPTALDH1A1TDP1POLBRAB9A
SCHEMBL9750060 0.71 RAB9A (0.43) MAPTALDH1A1GAAPOLBRAB9A
SCHEMBL9750085 0.71 NPC1 (0.50) MAPTALDH1A1TDP1POLBRAB9A
SCHEMBL9750417 0.70 MAPT (0.42) MAPTALDH1A1GAATDP1POLB

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
US-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed