SCHEMBL9659502

SCHEMBL9659502

CCN(CC)c1ccc2c(c1)Oc1cc(C)c(C)cc1C2c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
GAA P10253 4/20 0.47
CASP1 P29466 4/20 0.47
CASP7 P55210 4/20 0.47
CYP3A4 P08684 3/20 0.47
TSHR P16473 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
HTT P42858 3/20 0.47
NPC1 O15118 3/20 0.47
USP2 O75604 2/20 0.47
BRCA1 P38398 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HBB P68871 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
S100B P04271 1/20 0.40
ALDH1A1 P00352 7/20 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
SCHEMBL82135 0.92 MEN1 (0.52) MEN1KMT2AGAACASP1CASP7
SCHEMBL11520111 0.83 MEN1 (0.48) MEN1KMT2AGAACASP1CASP7
SCHEMBL11289610 0.82 MEN1 (0.46) MEN1KMT2AGAACASP1CASP7
SCHEMBL8772391 0.82 MEN1 (0.43) MEN1KMT2AGAACASP1CASP7
SCHEMBL4070707 0.81 NPC1 (0.45) MEN1KMT2AGAACASP1CASP7
SCHEMBL8778047 0.80 NPSR1 (0.46) MEN1KMT2AGAACASP1CASP7
SCHEMBL7194575 0.78 MAPT (0.44) MEN1KMT2AGAACASP1CASP7
SCHEMBL18213659 0.77 KMT2A (0.42) MEN1KMT2AGAACASP1CASP7
SCHEMBL3891496 0.77 NPSR1 (0.46) MEN1KMT2AGAACASP1CASP7
SCHEMBL9803569 0.76 ALDH1A1 (0.43) MEN1KMT2AGAACASP1CASP7

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 7 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-0133182-B1 OXIDATION-REDUCTION COLOR PRODUCTION-TYPE HEAT-SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-03-15 EP disclosed
EP-0055847-B1 PRESSURE SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-04-02 EP disclosed
US-4561000-A METHINE-TYPE CHROMOGEN, BENZOQUINONE OXIDIZER, COLOR PRODUCTION SENSITIVITY REGULATOR, SUBSTRATE MITSUI TOATSU CHEMICALS, INC. (JP) 1985-12-24 US disclosed
EP-0133182-A1 OXIDATION-REDUCTION COLOR PRODUCTION-TYPE HEAT-SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-02-20 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