SCHEMBL785968

SCHEMBL785968

CC(C)N(C(=O)c1ccccc1Cl)C1CCc2ccc(C(=O)O)cc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 6/20 0.47
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 1/20 0.37
DRD3 P35462 1/20 0.37
PYGL P06737 2/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
NR1I2 O75469 1/20 0.35

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
SCHEMBL785967 1.00 TRPM8 (0.47) TRPM8HPGDTSHRMAPTHTT
SCHEMBL803189 0.89 TRPM8 (0.43) TRPM8HPGDTSHRMAPTPOLB
SCHEMBL784544 0.88 TRPM8 (0.43) TRPM8DRD3
SCHEMBL785923 0.88 TRPM8 (0.43) TRPM8DRD3
SCHEMBL785536 0.87 TRPM8 (0.47) TRPM8HPGDPYGLALDH1A1NR1I2
SCHEMBL803263 0.87 TRPM8 (0.47) TRPM8DRD3PYGLNR1I2
SCHEMBL803766 0.87 TRPM8 (0.47) TRPM8HPGDPYGLALDH1A1NR1I2
SCHEMBL784897 0.87 TRPM8 (0.47) TRPM8DRD3PYGLNR1I2
SCHEMBL803606 0.86 TRPM8 (0.42) TRPM8NPSR1DRD3ADRB1ADRB3
SCHEMBL784735 0.86 TRPM8 (0.42) TRPM8NPSR1DRD3ADRB1ADRB3

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 TRPM8 180/4885HPGD 1082/4885TSHR 586/4885

“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.