SCHEMBL9734337

SCHEMBL9734337

CCCCc1ccc(C)c(CC)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.56
CYP3A4 P08684 3/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
HPGD P15428 2/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 1/20 0.44
CYP4Z1 Q86W10 1/20 0.44
CYP4F11 Q9HBI6 1/20 0.44
CYP4F12 Q9HCS2 1/20 0.44
CA2 P00918 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL11366320 0.90 SKP2 (0.58) SKP2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL11366365 0.88 SKP2 (0.56) SKP2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL9656290 0.88 CNR1 (0.45) SKP2CYP3A4CYP2D6CYP2C9CA2
SCHEMBL17733293 0.85 SKP2 (0.44) SKP2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL7169112 0.84 SKP2 (0.52) SKP2CYP3A4CYP2D6CYP2C9MAPK1
SCHEMBL19314032 0.84 SKP2 (0.61) SKP2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL9734644 0.83 SKP2 (0.50) SKP2HPGDNPC1MAPK1HTT
SCHEMBL15787340 0.83 BACE1 (0.50) SKP2BACE1
SCHEMBL10601286 0.82 ESR1 (0.50) SKP2CYP3A4MAPK1HTTNPSR1
SCHEMBL1413328 0.82 ESR1 (0.50) SKP2CYP3A4MAPK1HTTNPSR1

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
CN-1018908-B COLOR-DEVELOPING SHEETS USING IN PRESSURE-SENSING CARBON PAPER MITSUI TOATSU CHEMICALS (JP) 1992-11-04 CN disclosed
EP-0233450-B1 LINEAR SALICYLIC ACID COPOLYMERS AND THEIR METAL SALTS, PRODUCTION PROCESS THEREOF, COLOR-DEVELOPING AGENTS COMPRISING METAL-RESINS OF THE COPOLYMERS, AND COLOR-DEVELOPING SHEETS EMPLOYING THE AGENTS MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-03-11 EP disclosed
CN-1007814-B Linear salicylic acid copolymer and method for producing metal salt thereof, and color-developing agent containing copolymer metal salt, and color-developing paper using the same MITSUI TOATSU CHEMICALS (JP) 1990-05-02 CN disclosed
CN-1040543-A Linear salicylic acid copolymer, process for producing metal salt thereof, color-developing agent containing copolymer metal salt, and color-developing paper using the same MITSUI TOATSU CHEMICALS (JP) 1990-03-21 CN disclosed
US-4783521-A Linear salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal-resins of the copolymers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-11-08 US disclosed
CN-87100709-A Linear salicylic acid copolymer and method for producing metal salt thereof, and color-developing agent containing copolymer metal salt, and color-developing paper using the same 1987-09-02 CN disclosed
EP-0233450-A2 Linear salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal-resins of the copolymers, and color-developing sheets employing the agents MITSUI TOATSU CHEMICALS, Inc. (JP) 1987-08-26 EP disclosed