SCHEMBL6259652

SCHEMBL6259652

CCCCCCCCC(CCCCCC)Cc1ccccc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
FOLH1 Q04609 2/20 0.55
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
TSHR P16473 3/20 0.46
LMNA P02545 1/20 0.46
PTPN11 Q06124 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP3A4 P08684 2/20 0.44
CA2 P00918 1/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
CYSLTR2 Q9NS75 2/20 0.44
CYSLTR1 Q9Y271 2/20 0.44
HDAC3 O15379 2/20 0.43
HDAC1 Q13547 2/20 0.43

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
SCHEMBL8680643 1.00 ALDH1A1 (0.55) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL6263207 0.98 ALDH1A1 (0.53) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL16167161 0.95 FOLH1 (0.50) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL131266 0.88 ALDH1A1 (0.55) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL31073993 0.88 ALDH1A1 (0.55) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL26597207 0.87 ALDH1A1 (0.48) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL3526217 0.87 FOLH1 (0.53) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL10629058 0.87 CYSLTR2 (0.56) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL27681648 0.87 CYP3A4 (0.51) ALDH1A1FOLH1PRSS1PRSS2PRSS3
SCHEMBL15512121 0.87 ALDH1A1 (0.57) ALDH1A1FOLH1PRSS1PRSS2PRSS3

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-0848944-B1 Sunscreen composition comprising long, branched chain alkyl benzoates or hydroxybenzoates CPH INNOVATIONS CORP (US) 2005-11-02 EP claimed
EP-1002523-B1 Cosmetic sunscreening compositions OREAL (FR) 2004-03-03 EP claimed