SCHEMBL8829022

SCHEMBL8829022

CCCCCc1cc(O)c2c(c1)NC(C)(C)C1=C2CC(C)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 10/20 0.65
▸ CNR1 P21554 9/20 0.65
▸ MEN1 O00255 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ OPRM1 P35372 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.37
▸ TRPV1 Q8NER1 2/20 0.36
▸ FAAH O00519 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ LDHA P00338 1/20 0.36
▸ GLRA1 P23415 1/20 0.36
▸ GPR183 P32249 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ ENPP2 Q13822 1/20 0.36
▸ GPR18 Q14330 1/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ ABHD12 Q8N2K0 1/20 0.36
▸ ABHD6 Q9BV23 1/20 0.36
▸ GPR55 Q9Y2T6 1/20 0.36

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
SCHEMBL8828977 0.81 CNR2 (0.65) CNR2CNR1MEN1GAAKMT2A
SCHEMBL31103617 0.79 CNR2 (1.00) CNR2CNR1MEN1GAAKMT2A
SCHEMBL4537590 0.79 CNR2 (1.00) CNR2CNR1MEN1GAAKMT2A
SCHEMBL5090381 0.79 CNR2 (1.00) CNR2CNR1MEN1GAAKMT2A
SCHEMBL1114914 0.78 CNR2 (0.98) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11599749 0.76 CNR1 (0.73) CNR2CNR1MEN1GAAKMT2A
SCHEMBL16124349 0.75 CNR2 (0.94) CNR2CNR1MEN1GAAKMT2A
SCHEMBL11602695 0.74 CNR2 (0.58) CNR2CNR1OPRM1ACE2TRPV1
SCHEMBL11601783 0.73 CNR2 (0.57) CNR2CNR1OPRM1ACE2TRPV1
SCHEMBL11602544 0.73 CNR2 (0.57) CNR2CNR1OPRM1ACE2TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605906-A LOWERING OCULAR PRESSURE; ANTIINFLAMMATORY AGENT; IMMUNOSUPPRESSIVE; ANALGESICS MERCK FROSST CANADA, INC. (CA) 1997-02-25 — — US disclosed
US-4405626-A TRANQUILIZERS, HYPOTENSIVE AGENTS; DIURETICS; VISION DEFECTS PFIZER INC. (US) 1983-09-20 — — US disclosed
US-4400385-A TRANQUILIZERS, HYPOTENSIVE AGENTS; DIURETICS; VISION DEFECTS PFIZER INC. (US) 1983-08-23 — — US disclosed
US-4380542-A ANALGESICS, TRANQUILIZERS PFIZER (US) 1983-04-19 — — US disclosed
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-4351833-A 9-Amino-1-hydroxyoctahydrobenzo[c]quinolines and derivatives thereof as analgesics and anti-emetics PFIZER INC. (US) 1982-09-28 — — US disclosed
US-4340737-A CNS AGENTS, HYPOTENSIVES, DIURETICS AND AGENTS FOR TREATMENT OF GLAUCOMA PFIZER INC. (US) 1982-07-20 — — US disclosed
EP-0045171-A2 9-Amino-1-hydroxyoctahydrobenzo(c)quinolines and derivatives thereof PFIZER INC. (US) 1982-02-03 — — EP disclosed
US-4309545-A ANALGESICS, TRANQUILIZERS, ANTIEMETICS, DIURETICS, ANTICONVULSANTS, ANTIDIARRHEAL, ANTITUSSIVES AND IN THE TREATMENT OF GLAUCOMA PFIZER INC. (US) 1982-01-05 — — US disclosed
US-4260764-A ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1981-04-07 — — US disclosed
US-4206225-A ANALGESICS PFIZER INC. (US) 1980-06-03 — — US disclosed
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