SCHEMBL1345124

SCHEMBL1345124

CCCc1ccc(O)c(C(c2ccccc2)c2cc(CCC)cc(C(c3ccccc3)c3cc(CCC)cc(C(c4ccccc4)c4cc(CCC)cc(C(c5ccccc5)c5cc(CCC)ccc5O)c4O)c3O)c2O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
HKDC1 Q2TB90 1/20 0.39
ALOX5 P09917 1/20 0.38
MCL1 Q07820 1/20 0.38
IGF1R P08069 1/20 0.37
ALOX15 P16050 1/20 0.37
GAA P10253 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL1345916 1.00 CNR1 (0.46) CNR1CNR2HKDC1ALOX5MCL1
SCHEMBL1345123 1.00 CNR1 (0.46) CNR1CNR2HKDC1ALOX5MCL1
SCHEMBL1345672 1.00 CNR1 (0.46) CNR1CNR2HKDC1ALOX5MCL1
SCHEMBL50806 0.94 CNR1 (0.51) CNR1CNR2HKDC1ALOX5MCL1
SCHEMBL1344636 0.85 TRPA1 (0.44) HKDC1ALOX15GAAKMT2ANPSR1
SCHEMBL1344545 0.85 TRPA1 (0.44) HKDC1ALOX15GAAKMT2ANPSR1
SCHEMBL1344862 0.85 TRPA1 (0.44) HKDC1ALOX15GAAKMT2ANPSR1
SCHEMBL1345096 0.85 TRPA1 (0.44) HKDC1ALOX15GAAKMT2ANPSR1
SCHEMBL27919484 0.82 IGF1R (0.46) CNR1CNR2IGF1RALOX15GAA
SCHEMBL51302 0.82 TRPA1 (0.50) HKDC1ALOX15GAAKMT2ANPSR1

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
EP-1724119-B1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS MITSUBISHI CHEM CORP (JP) 2014-11-19 EP disclosed
US-8062993-B2 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2011-11-22 US disclosed
US-20070173407-A1 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2007-07-26 US disclosed
EP-1724119-A1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS API Corporation (JP) 2006-11-22 EP disclosed