SCHEMBL784631

SCHEMBL784631

CC(C)N(C(=O)c1ccccc1Cl)C1CCc2cc(C(=O)O)c(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 11/20 0.41
NR1I2 O75469 2/20 0.39
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
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.37
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
TP53 P04637 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
SCHEMBL785962 1.00 TRPM8 (0.41) TRPM8NR1I2HPGDTSHRMAPT
SCHEMBL803191 0.90 TRPM8 (0.40) TRPM8NR1I2HPGDTSHRMAPT
SCHEMBL784980 0.85 SLC6A2 (0.42) TRPM8NR1I2HPGDALDH1A1SLC6A2
SCHEMBL803560 0.85 SLC6A2 (0.42) TRPM8NR1I2HPGDALDH1A1SLC6A2
SCHEMBL785967 0.85 TRPM8 (0.47) TRPM8NR1I2HPGDTSHRMAPT
SCHEMBL785968 0.85 TRPM8 (0.47) TRPM8NR1I2HPGDTSHRMAPT
SCHEMBL883606 0.80 SLC6A2 (0.41) TRPM8NR1I2HPGDALDH1A1SLC6A2
SCHEMBL784054 0.78 HPGD (0.41) TRPM8HPGDTSHR
SCHEMBL803189 0.78 TRPM8 (0.43) TRPM8HPGDTSHRMAPTALDH1A1
SCHEMBL784735 0.78 TRPM8 (0.42) TRPM8NR1I2NPSR1SLC6A2SLC6A4

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 180/4885NR1I2 1112/4885HPGD 1082/4885

“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.