SCHEMBL11254004

SCHEMBL11254004

CC(CCCc1ccccc1)c1cc2c(cc1O)C1=C(CCCC1=O)C(C)(C)N2C=O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ CSNK2A1 P68400 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ FAAH O00519 7/20 0.31
▸ MGLL Q99685 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CARM1 Q86X55 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
SCHEMBL11252762 0.89 CSNK2A2 (0.34) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11487635 0.81 MAOA (0.33) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11492319 0.80 ADRB2 (0.34) MAOAMAOBALDH1A1MAPT
SCHEMBL11489174 0.80 CSNK2A2 (0.35) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11486138 0.79 FAAH (0.35) FAAHMGLLALDH1A1
SCHEMBL11493781 0.74 OPRM1 (0.31) —
SCHEMBL11487777 0.74 MAOB (0.39) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11493129 0.74 FAAH (0.31) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11486194 0.70 MAOA (0.33) MAOAMAOBCSNK2A2CSNK2BCSNK2A1
SCHEMBL11252918 0.70 — —

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
EP-0009386-B1 2,10-DISUBSTITUTED DIBENZO(B,D)PYRANS AND BENZO(C)QUINOLINES AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. (US) 1982-11-17 — — EP disclosed
US-4206225-A ANALGESICS PFIZER INC. (US) 1980-06-03 — — US disclosed
EP-0009386-A1 2,10-Disubstituted dibenzo(b,d)pyrans and benzo(c)quinolines and pharmaceutical compositions thereof PFIZER INC. (US) 1980-04-02 — — EP disclosed
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