SCHEMBL9658173

SCHEMBL9658173

CCOc1ccc(C(c2c(C)n(CC)c3ccccc23)c2c(C)n(CC)c3ccccc23)cc1OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
LMNA P02545 2/20 0.48
MAPT P10636 8/20 0.47
GAA P10253 6/20 0.47
TDP1 Q9NUW8 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CYP19A1 P11511 2/20 0.43
TP53 P04637 2/20 0.42
CNR2 P34972 2/20 0.40
THRB P10828 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NSD2 O96028 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TNF P01375 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
SCHEMBL9659512 0.86 ALDH1A1 (0.47) ALDH1A1LMNAMAPTGAATDP1
SCHEMBL9626437 0.84 TP53 (0.46) ALDH1A1LMNAMAPTTDP1KMT2A
SCHEMBL9657071 0.83 KMT2A (0.45) ALDH1A1MAPTGAATDP1KMT2A
SCHEMBL9658950 0.81 CYP19A1 (0.41) ALDH1A1LMNAMAPTGAATDP1
SCHEMBL254024 0.81 MAPT (0.52) ALDH1A1LMNAMAPTTDP1KMT2A
SCHEMBL30898583 0.81 MAPT (0.52) ALDH1A1LMNAMAPTTDP1KMT2A
SCHEMBL10526623 0.80 CYP19A1 (0.46) ALDH1A1LMNAMAPTTDP1KMT2A
SCHEMBL9657076 0.79 CYP19A1 (0.52) ALDH1A1LMNAMAPTGAATDP1
SCHEMBL30587346 0.79 CYP19A1 (0.48) ALDH1A1LMNAMAPTTDP1KMT2A
SCHEMBL7454319 0.79 CYP19A1 (0.48) ALDH1A1LMNAMAPTTDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5130291-A HEAT-SENSITIVE RECORDING PAPER OSAKA SEALING PRINTING CO., LTD. (JP) 1992-07-14 US disclosed
EP-0055847-B1 PRESSURE SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-04-02 EP disclosed
US-4398753-A METHINE-TYPE DYES AND QUINONE DERIVATIVE IN REDOX SYSTEM FOR CARBON-FREE REPRODUCTION MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-16 US disclosed
EP-0055847-A1 Pressure sensitive recording unit MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-14 EP disclosed