SCHEMBL9734907

SCHEMBL9734907

CCCc1ccc(CC)c(CC)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
BACE1 P56817 1/20 0.47
DHFR P00374 1/20 0.42
CA2 P00918 1/20 0.42
ALOX5 P09917 1/20 0.42
GPR84 Q9NQS5 2/20 0.41
LPL P06858 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
MGLL Q99685 1/20 0.39
PLK1 P53350 1/20 0.39
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MCL1 Q07820 1/20 0.37

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
SCHEMBL11010600 0.89 CNR1 (0.44) CNR1CNR2BACE1DHFRCA2
SCHEMBL11010604 0.87 CNR1 (0.47) CNR1CNR2BACE1CA2ALOX5
SCHEMBL9734644 0.86 SKP2 (0.50) BACE1CA2GPR84PLK1THRB
Phenol SCHEMBL28331307 0.85 CNR1 (0.46) CNR1CNR2BACE1ALOX5GPR84
SCHEMBL11791277 0.84 TRPA1 (0.41) CNR1CNR2BACE1DHFRCA2
SCHEMBL9740304 0.83 CNR1 (0.50) CNR1CNR2BACE1CA2ALOX5
SCHEMBL444673 0.82 TRPA1 (0.48) BACE1DHFRCA2L3MBTL1
SCHEMBL9656290 0.82 CNR1 (0.45) CNR1CNR2BACE1CA2ALOX5
SCHEMBL20124807 0.82 SKP2 (0.46) CNR1CNR2BACE1CA2ALOX5
SCHEMBL12441747 0.82 BACE1 (0.44) CNR1CNR2BACE1DHFRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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