SCHEMBL785744

SCHEMBL785744

CCN(C(=O)c1cccc(F)c1Cl)C1CCc2ccc(C(=O)O)cc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.43
SLC6A4 P31645 4/20 0.43
SLC6A3 Q01959 4/20 0.43
DRD3 P35462 1/20 0.39
TRPM8 Q7Z2W7 4/20 0.36
P2RX3 P56373 2/20 0.34
P2RX2 Q9UBL9 2/20 0.34
ACHE P22303 1/20 0.34
DRD2 P14416 1/20 0.33
WDR5 P61964 1/20 0.33
OPRD1 P41143 2/20 0.33
OPRM1 P35372 1/20 0.33
ESR1 P03372 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR5 Q9H1C0 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
SCHEMBL803284 1.00 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL803734 0.90 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ACHEDRD2
SCHEMBL785540 0.87 TRPM8 (0.40) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL803262 0.87 TRPM8 (0.40) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL785598 0.86 RORC (0.41) DRD3
SCHEMBL785597 0.86 RORC (0.41) DRD3
SCHEMBL785167 0.86 TP53 (0.43) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL785978 0.86 TP53 (0.43) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL784735 0.84 TRPM8 (0.42) SLC6A2SLC6A4SLC6A3DRD3TRPM8
SCHEMBL803606 0.84 TRPM8 (0.42) SLC6A2SLC6A4SLC6A3DRD3TRPM8

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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 SLC6A2 1966/4885SLC6A4 1682/4885SLC6A3 1597/4885

“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.