SCHEMBL3360947

SCHEMBL3360947

CCCCCCC(CCCC)COc1ccc(-c2nc(-c3ccc(OCC(CCCC)CCCCCC)c(C)c3O)nc(-c3cn(C)c4ccccc34)n2)c(O)c1C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.32

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
SCHEMBL3363710 0.94 ALDH1A1 (0.37) ALDH1A1
SCHEMBL3360185 0.88 PRSS1 (0.33) ALDH1A1
SCHEMBL3469000 0.83
SCHEMBL3361773 0.83 CA2 (0.33) ALDH1A1
SCHEMBL3468759 0.82 PRSS1 (0.30)
SCHEMBL3360193 0.80 CYP1A2 (0.35)
SCHEMBL13271132 0.80 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3468887 0.77 KCNA3 (0.31)
SCHEMBL3469027 0.77 PRSS1 (0.32)
SCHEMBL3468877 0.77 ALDH1A1 (0.33) ALDH1A1

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-2210887-A1 Bis resorcinyl triazine derivatives as protecting agents against UV radiation ISDIN, S.A. (ES) 2010-07-28 EP claimed
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO claimed
EP-2210887-A1 Bis resorcinyl triazine derivatives as protecting agents against UV radiation ISDIN, S.A. (ES) 2010-07-28 EP disclosed
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO disclosed