SCHEMBL5575368

SCHEMBL5575368

NC(CNC1CCSCC1)c1cccc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 11/20 0.39
OPRD1 P41143 11/20 0.39
OPRK1 P41145 11/20 0.39
OPRL1 P41146 11/20 0.39
ADRB3 P13945 5/20 0.39
MAPK1 P28482 1/20 0.36
ADRB1 P08588 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
SCHEMBL5575277 0.87 GLA (0.43) OPRM1OPRD1OPRK1OPRL1ADRB3
SCHEMBL5573889 0.86 KDM4E (0.45) OPRM1OPRD1OPRK1OPRL1ADRB3
SCHEMBL18298572 0.73 POLB (0.45) OPRM1OPRD1OPRK1OPRL1
SCHEMBL21539590 0.73 POLB (0.45) OPRM1OPRD1OPRK1OPRL1
SCHEMBL5848565 0.73 ADRB2 (0.57) ADRB3ADRB1
SCHEMBL4598198 0.72 CTSL (0.41) ADRB3ADRB1
SCHEMBL9902866 0.71 SLC6A4 (0.49) ADRB3ADRB1
SCHEMBL16690960 0.71 SLC6A4 (0.49) ADRB3ADRB1
SCHEMBL1565019 0.70 TAAR1 (0.51)
SCHEMBL2677605 0.69 OPRL1 (0.59) OPRM1OPRD1OPRK1OPRL1

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-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 OPRM1 205/4885OPRD1 330/4885OPRK1 197/4885

“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.