SCHEMBL10365544

SCHEMBL10365544

CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)CC2=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 14/20 0.57
▸ CNR2 P34972 13/20 0.57
▸ ALDH1A1 P00352 1/20 0.54
▸ NR1I2 O75469 1/20 0.52
▸ ADORA3 P0DMS8 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52

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
SCHEMBL10988783 0.81 CNR2 (0.51) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL10990917 0.79 CNR1 (0.50) CNR1CNR2
SCHEMBL11605812 0.78 CNR1 (0.50) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL10365477 0.78 CNR2 (0.62) CNR1CNR2
SCHEMBL10989218 0.77 ALDH1A1 (0.60) CNR1CNR2ALDH1A1
SCHEMBL31545670 0.77 CNR2 (0.53) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL19281379 0.76 CNR1 (0.56) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL10367356 0.75 CNR2 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11371918 0.75 CNR2 (0.55) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL10365457 0.74 CNR2 (0.58) CNR1CNR2NR1I2ADORA3SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0089781-B1 BICYCLIC BENZO FUSED COMPOUNDS PFIZER INC. (US) 1990-08-08 — — EP disclosed
US-4870084-A ANALGESICS, ANTIDIARRHEALS PFIZER INC. (US) 1989-09-26 — — US disclosed
US-4863934-A Bicyclic benzo fused pyran compounds used for producing analgesia PFIZER INC. (US) 1989-09-05 — — US disclosed
US-4841078-A ANALGESICS PFIZER INC. (US) 1989-06-20 — — US disclosed
US-4680404-A ANALGESICS, TRANQUILIZERS, ANTIEMETICS, DIURETICS, ANTICONVULSANTS PFIZER INC. (US) 1987-07-14 — — US disclosed
US-4486428-A ANALGESICS, ANTIEMETICS PFIZER INC. (US) 1984-12-04 — — US disclosed
EP-0089781-A2 Bicyclic benzo fused compounds PFIZER INC. (US) 1983-09-28 — — EP disclosed
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