SCHEMBL9550460

SCHEMBL9550460

O=C(Cl)Cc1cccc2occc12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.48
OPRK1 P41145 6/20 0.48
MTNR1A P48039 2/20 0.46
MTNR1B P49286 2/20 0.46
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
FTO Q9C0B1 1/20 0.43
EED O75530 3/20 0.41
TDP1 Q9NUW8 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
SCHEMBL1282582 0.86 OPRM1 (0.48) OPRM1OPRK1MTNR1AMTNR1BMAOA
Hydrochloric Acid SCHEMBL29878326 0.85 OPRM1 (0.47) OPRM1OPRK1MTNR1AMTNR1BMAOA
SCHEMBL2263418 0.84 TDP1 (0.53) OPRM1OPRK1MTNR1AMTNR1BEED
SCHEMBL31425844 0.84 TDP1 (0.53) OPRM1OPRK1MTNR1AMTNR1BEED
SCHEMBL5986566 0.83 MTNR1A (0.49) OPRM1OPRK1MTNR1AMTNR1BMAOA
SCHEMBL9911545 0.80 MTNR1A (0.47) OPRM1OPRK1MTNR1AMTNR1BMAOA
SCHEMBL31426029 0.76 MTNR1A (0.47) OPRM1OPRK1MTNR1AMTNR1BMAOB
SCHEMBL3794946 0.76 MTNR1A (0.51) OPRM1OPRK1MTNR1AMTNR1BMAOA
SCHEMBL5357479 0.76 MAOB (0.47) OPRM1OPRK1MTNR1AMTNR1BMAOA
SCHEMBL27940164 0.76 EED (0.46) OPRM1OPRK1MTNR1AMTNR1BMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5194465-A None JP disclosed
JP-H05194465-A 2-AMINO-MONO-METHOXYCYCLOHEXYLAMIDES USEFUL AS ANALGESIC WARNER LAMBERT CO 1993-08-03 JP disclosed
EP-0552386-A1 2-Amino-3 or 6-methoxycyclohexyl amide derivatives WARNER-LAMBERT COMPANY (US) 1993-07-28 EP disclosed
US-5051428-A 2-amino-4 or 5-methoxycyclohexyl amides useful as analgesics WARNER-LAMBERT COMPANY (US) 1991-09-24 US disclosed
EP-0372466-A2 2-Amino-4 or 5-methoxycyclohexyl amides useful as analgesics WARNER-LAMBERT COMPANY (US) 1990-06-13 EP disclosed