SCHEMBL3469018

SCHEMBL3469018

CCCCCCCCC(CCCCCC)COc1ccc(-c2nc(-c3ccc(OCC(CCCCCC)CCCCCCCC)c(C)c3O)nc(-c3cccn3Cc3ccccc3)n2)c(O)c1C

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 2/20 0.32
MAPK14 Q16539 1/20 0.31
PTGES O14684 1/20 0.31
ALOX5 P09917 1/20 0.31
PPARG P37231 1/20 0.31
POLB P06746 1/20 0.31
SIGMAR1 Q99720 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
CTRC Q99895 1/20 0.30
AGTR1 P30556 1/20 0.30
AGTR2 P50052 1/20 0.30

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
SCHEMBL3468887 0.99 KCNA3 (0.31) KCNA3MAPK14PTGESALOX5PPARG
SCHEMBL3468902 0.93 ALDH1A1 (0.32) MAPK14KDM4EALDH1A1GLAGAA
SCHEMBL3468897 0.90 LMNA (0.31) ALDH1A1
SCHEMBL3468817 0.90 LMNA (0.32) ALDH1A1
SCHEMBL3468763 0.89 TP53 (0.35) MAPK14POLBALDH1A1HPGD
SCHEMBL3469027 0.87 PRSS1 (0.32)
SCHEMBL3468759 0.86 PRSS1 (0.30)
SCHEMBL3469000 0.85
SCHEMBL3468911 0.83 LMNA (0.32) PTGESALOX5PPARGALDH1A1AGTR1
SCHEMBL3469062 0.82 LMNA (0.32) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO claimed
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO disclosed