SCHEMBL9734644

SCHEMBL9734644

CCCCc1ccc(CC)c(CC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.50
HPGD P15428 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CA2 P00918 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
BACE1 P56817 1/20 0.44
CA1 P00915 1/20 0.44
GPR84 Q9NQS5 2/20 0.44
RARB P10826 1/20 0.43
PLK1 P53350 1/20 0.43
TYR P14679 1/20 0.42
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 1/20 0.42
THRA P10827 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
SCHEMBL9734907 0.86 CNR1 (0.48) CA2BACE1GPR84PLK1THRB
SCHEMBL27727868 0.85 TYR (0.46) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL9485320 0.84 SKP2 (0.52) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL9734337 0.83 SKP2 (0.56) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL5185058 0.83 BACE1 (0.55) BACE1
SCHEMBL19314032 0.83 SKP2 (0.61) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL28004760 0.83 SKP2 (0.50) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL23644200 0.82 SKP2 (0.46) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL18378514 0.82 SKP2 (0.46) SKP2HPGDALDH1A1HSD17B10CA2
SCHEMBL11043970 0.82 BACE1 (0.41) SKP2ALDH1A1BACE1KAT8PPARA

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
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