SCHEMBL19337410

SCHEMBL19337410

Cc1ccc(C2CCCCC2)c2c1O2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CEL P19835 2/20 0.40
PSMB5 P28074 2/20 0.35
TDO2 P48775 1/20 0.34
HTR2C P28335 3/20 0.33
OPRL1 P41146 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
SLC6A3 Q01959 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL6390262 0.71 HTR2C (0.50) CELPSMB5HTR2COPRL1
SCHEMBL15845261 0.71
SCHEMBL533559 0.71 HTR2C (0.46) CELPSMB5TDO2HTR2C
SCHEMBL10030799 0.71 OPRL1 (0.38) CELPSMB5HTR2COPRL1
SCHEMBL23854308 0.71 ADRA2A (0.41) CELPSMB5HTR2CADRA2AADRA2B
SCHEMBL23334009 0.71 ADRA2A (0.37) HTR2COPRL1ADRA2AADRA2B
SCHEMBL7650801 0.69 CYP1A2 (0.50) CELPSMB5HTR2C
SCHEMBL12716351 0.69 OPRL1 (0.40) CELPSMB5HTR2COPRL1
SCHEMBL6259417 0.69 HTR2C (0.41) CELPSMB5HTR2COPRL1PTGDR2
SCHEMBL20676750 0.69 FEN1 (0.39) CELPSMB5HTR2CADRA2AADRA2B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2701673-B1 DYE COMPOSITION USING A PARTICULAR PHENOLIC COUPLER IN A MEDIUM RICH IN FATTY SUBSTANCES, PROCESSES AND DEVICES L'ORÉAL (FR) 2017-09-13 EP disclosed