SCHEMBL10367370

SCHEMBL10367370

CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)C(c1ccc([N+](=O)[O-])cc1)C2C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 15/20 0.52
▸ CNR1 P21554 11/20 0.52
▸ NR1I2 O75469 1/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ SLC6A3 Q01959 1/20 0.50
▸ DRD3 P35462 1/20 0.48
▸ GLRA1 P23415 1/20 0.47

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
SCHEMBL10367369 0.75 CNR2 (0.49) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10365457 0.73 CNR2 (0.58) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL15516023 0.71 CNR2 (0.56) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL29611573 0.71 CNR2 (0.74) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL23484633 0.71 CNR2 (0.74) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL23484632 0.71 CNR2 (0.74) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL120230 0.71 CNR2 (0.61) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL23484854 0.71 CNR2 (0.74) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL29611328 0.71 CNR2 (0.74) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL15516714 0.70 CNR2 (0.55) CNR2CNR1NR1I2ADORA3SLC6A3

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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