SCHEMBL9627686

SCHEMBL9627686

CCCCCCOc1c(OCC)cc(O)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43
NR5A1 Q13285 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
MAPT P10636 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HTT P42858 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ALOX5 P09917 1/20 0.39

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
SCHEMBL9627600 0.94 MEN1 (0.46) FAAHMGLLNR5A1MEN1KMT2A
SCHEMBL9629502 0.94 MEN1 (0.46) FAAHMGLLNR5A1MEN1KMT2A
SCHEMBL9627146 0.86 SLC2A1 (0.50) SLC2A1MEN1KMT2ALMNAMAPT
SCHEMBL9628299 0.83 EP300 (0.44) SLC2A1MEN1KMT2ALMNAMAPT
SCHEMBL9627812 0.81 MAPT (0.55) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL9656200 0.81 MEN1 (0.47) FAAHMGLLNR5A1MEN1KMT2A
SCHEMBL11497059 0.81 HTT (0.53) FAAHMGLLNR5A1LMNACYP3A4
SCHEMBL9628147 0.80 EP300 (0.51) SLC2A1MEN1KMT2ACYP3A4MAPT
SCHEMBL9629383 0.80 TOP2A (0.46) SLC2A1MEN1KMT2AMAPTHTT
SCHEMBL29700497 0.79 LMNA (0.44) FAAHMGLLNR5A1MEN1KMT2A

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 5 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
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282056-A2 Naphthalene 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