SCHEMBL785069

SCHEMBL785069

CN(C(=O)c1ccccc1Cl)[C@@H]1CCc2ccc(C(=O)O)cc21

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
TRPM8 Q7Z2W7 2/20 0.42
POLB P06746 1/20 0.42
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
SPR P35270 1/20 0.39
DRD3 P35462 1/20 0.39
PYGL P06737 2/20 0.38
HTT P42858 2/20 0.38
ALDH1A1 P00352 2/20 0.38
XBP1 P17861 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
P2RX7 Q99572 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
SCHEMBL484622 1.00 HPGD (0.49) HPGDTSHRTRPM8POLBADRB1
SCHEMBL13131593 0.88 HPGD (0.46) HPGDTSHRTRPM8POLBSPR
SCHEMBL803190 0.88 HPGD (0.46) HPGDTSHRTRPM8POLBSPR
SCHEMBL785415 0.87 SPR (0.41) TRPM8SPRDRD3HTTALDH1A1
SCHEMBL785072 0.87 SPR (0.41) TRPM8SPRDRD3HTTALDH1A1
SCHEMBL784876 0.87 TRPM8 (0.43) TRPM8DRD3PYGL
SCHEMBL803768 0.87 TRPM8 (0.43) TRPM8DRD3PYGL
SCHEMBL785078 0.87 TRPM8 (0.43) HPGDTRPM8PYGLALDH1A1
SCHEMBL785630 0.87 TRPM8 (0.43) HPGDTRPM8PYGLALDH1A1
SCHEMBL785968 0.86 TRPM8 (0.47) HPGDTSHRTRPM8POLBADRB1

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 7 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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
WO-2012038081-A1 SUBSTITUTED BENZAMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-03-29 WO disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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 HPGD 1082/4885TSHR 586/4885TRPM8 180/4885

“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.