SCHEMBL11325596

SCHEMBL11325596

CN(C)C1(C)CCCCCC1(C)c1cccc(O)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 9/20 0.46
▸ SLC6A4 P31645 8/20 0.46
▸ SLC6A2 P23975 6/20 0.46
▸ OPRD1 P41143 2/20 0.46
▸ OPRK1 P41145 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SLC22A1 O15245 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41

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
SCHEMBL11323565 0.98 OPRM1 (0.47) OPRM1SLC6A4SLC6A2OPRD1OPRK1
SCHEMBL11316996 0.95 OPRD1 (0.46) OPRM1SLC6A4SLC6A2OPRD1OPRK1
Hydrochloric Acid SCHEMBL11316784 0.94 OPRD1 (0.45) OPRM1SLC6A4SLC6A2OPRD1OPRK1
Hydrochloric Acid SCHEMBL11309559 0.81 OPRM1 (0.41) OPRM1SLC6A4SLC6A2OPRD1OPRK1
SCHEMBL2515981 0.81 OPRM1 (0.49) OPRM1SLC6A4SLC6A2OPRD1OPRK1
Hydrochloric Acid SCHEMBL2518902 0.80 OPRM1 (0.48) OPRM1SLC6A4SLC6A2OPRD1OPRK1
Hydrochloric Acid SCHEMBL2518903 0.80 OPRM1 (0.48) OPRM1SLC6A4SLC6A2OPRD1OPRK1
SCHEMBL11313951 0.79 SLC6A4 (0.47) OPRM1SLC6A4SLC6A2OPRD1OPRK1
Hydrochloric Acid SCHEMBL11319376 0.78 OPRM1 (0.47) OPRM1SLC6A4SLC6A2OPRD1OPRK1
SCHEMBL11307256 0.78 OPRL1 (0.47) OPRM1SLC6A4SLC6A2OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4287212-A USEFUL AS ANALGESICS AND DIURETICS AMERICAN HOECHST CORPORATION (US) 1981-09-01 — — US disclosed
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