SCHEMBL15043601

SCHEMBL15043601

CCCC1(c2ccc(F)cc2)CCOC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.42
SLC6A3 Q01959 3/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A2 P23975 1/20 0.41
ICMT O60725 2/20 0.39
OPRD1 P41143 1/20 0.37

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
SCHEMBL15043598 0.90 ICMT (0.46) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL10181623 0.83 OPRM1 (0.40) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL19262168 0.81 SLC6A3 (0.49) OPRM1SLC6A3SLC6A4SLC6A2
SCHEMBL29017386 0.80 SLC6A3 (0.42) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL29017330 0.80 SLC6A3 (0.42) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL12614285 0.80 SLC6A3 (0.45) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL14944312 0.78 SLC6A3 (0.59) SLC6A3SLC6A4SLC6A2
SCHEMBL12002387 0.76 SLC6A3 (0.62) SLC6A3SLC6A4SLC6A2
SCHEMBL12542428 0.73 SLC6A3 (0.50) OPRM1SLC6A3SLC6A4SLC6A2ICMT
SCHEMBL15043683 0.73 SLC6A4 (0.40) OPRM1SLC6A3SLC6A4SLC6A2ICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822510-B2 Substituted 3-phenyl-1,2,4-Oxadiazole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-02 US disclosed
US-20130158001-A1 SUBSTITUTED 3-PHENYL-1,2,4-OXADIAZOLE COMPOUNDS BRISTOL-MYERS SQUBIB COMPANY 2013-06-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130158001-A1 SUBSTITUTED 3-PHENYL-1,2,4-OXADIAZOLE COMPOUNDS S1PR1, S1PR3, S1PR2 OPRM1 744/4885SLC6A3 2766/4885SLC6A4 2698/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.