SCHEMBL11703178

SCHEMBL11703178

C[C@@]12CCCCCC(Cc3ccc(F)cc31)[C@@H]2N

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.72
▸ OPRK1 P41145 2/20 0.44
▸ OPRD1 P41143 1/20 0.44
▸ SIGMAR1 Q99720 4/20 0.40
▸ KDM1A O60341 2/20 0.40
▸ TMEM97 Q5BJF2 1/20 0.39
▸ DPP4 P27487 1/20 0.35
▸ PITRM1 Q5JRX3 1/20 0.35
▸ DPP8 Q6V1X1 1/20 0.35
▸ DPP9 Q86TI2 1/20 0.35
▸ OPRL1 P41146 1/20 0.34
▸ ACHE P22303 1/20 0.33
▸ SRD5A1 P18405 1/20 0.33
▸ BACE1 P56817 1/20 0.33

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
SCHEMBL11703175 1.00 OPRM1 (0.72) OPRM1OPRK1OPRD1SIGMAR1KDM1A
Dezocine SCHEMBL3072 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL11874190 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL1369581 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL11874182 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL9685743 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL7781933 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL12720257 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL21081189 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1
Dezocine SCHEMBL25583319 0.84 OPRM1 (1.00) OPRM1OPRK1OPRD1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4049701-A ANALGESICS, ANTIINFLAMMATORY AMERICAN HOME PRODUCTS CORPORATION (US) 1977-09-20 — — US disclosed
US-4001326-A ANALGESICS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1977-01-04 — — US disclosed
US-4001331-A ANTIINFLAMMATORY, ANALGESIC AMERICAN HOME PRODUCTS CORPORATION (US) 1977-01-04 — — US disclosed
US-3979434-A ANALGESICS, ANTIINFLAMMATORY AMERICAN HOME PRODUCTS CORPORATION (US) 1976-09-07 — — US disclosed
US-3976696-A ANALGESIC, ANTIINFLAMMATORY AMERICAN HOME PRODUCTS CORPORATION (US) 1976-08-24 — — US disclosed
US-3976693-A ANALGESIC, ANTIINFLAMMATORY AMERICAN HOME PRODUCTS CORPORATION (US) 1976-08-24 — — US disclosed
US-3957872-A ANALGESICS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1976-05-18 — — US disclosed
US-3937736-A ANALGESICS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1976-02-10 — — US disclosed
US-3931328-A CARBURETOR AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-06 — — US disclosed
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