SCHEMBL9660688

SCHEMBL9660688

CCCCCCOc1cc(OCCCCCC)c2ccccc2c1OC(=O)NC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
MEN1 O00255 1/20 0.45
NR1I2 O75469 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
MAPT P10636 1/20 0.45
OPRK1 P41145 1/20 0.45
HTR2B P41595 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
CYP2C9 P11712 1/20 0.44
S1PR5 Q9H228 2/20 0.43
EPHX1 P07099 1/20 0.43
FAAH O00519 9/20 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
SCHEMBL9657973 1.00 CNR1 (0.46) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9657991 0.96 SLC2A1 (0.44) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9659029 0.91 CNR1 (0.46) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9658002 0.91 CNR1 (0.46) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9659348 0.91 ALDH1A1 (0.44) CNR1CNR2MEN1LMNAMAPT
SCHEMBL9659389 0.87 SLC2A1 (0.45) CNR1CNR2THRATHRBEPHX1
SCHEMBL9658025 0.86 CNR1 (0.47) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9657883 0.86 CNR1 (0.47) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9660327 0.86 HTT (0.50) CNR1CNR2MEN1NR1I2LMNA
SCHEMBL9660579 0.85 ALDH1A1 (0.47) LMNAALDH1A1PGRGAAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed