SCHEMBL839470

SCHEMBL839470

COC(=O)c1cccc(C2CCCN2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
CHRNB2 P17787 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRNA4 P43681 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL10311104 1.00 PRMT5 (0.45) PRMT5WDR77CHRNB2CHRNA7CHRNA4
Hydrochloric Acid SCHEMBL10277298 0.99 PRMT5 (0.45) PRMT5WDR77CHRNB2CHRNA7CHRNA4
SCHEMBL10311097 0.84 CHRNB2 (0.46) PRMT5WDR77CHRNB2CHRNA7CHRNA4
SCHEMBL13741356 0.82 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1KDM4ETSHR
SCHEMBL24726533 0.82 KMO (0.58) PRMT5WDR77CHRNB2CHRNA7CHRNA4
SCHEMBL29285106 0.82 KMO (0.58) PRMT5WDR77CHRNB2CHRNA7CHRNA4
SCHEMBL29285083 0.82 ALDH1A1 (0.46) ALDH1A1KDM4ECYP4F2CYP4A11RAB9A
SCHEMBL4150927 0.80 MEN1 (0.47) CHRNB2CHRNA4KMT2AMEN1ALDH1A1
SCHEMBL24527009 0.80 KCNH2 (0.40) KMT2AMEN1ALDH1A1KDM4E
SCHEMBL231800 0.80 DRD2 (0.51)

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118265696-A Aryl carboxylic acid compound and application thereof in preparation of Mrgpr X < 4 > inhibitor 深圳博瑞医药科技有限公司 2024-06-28 CN disclosed
WO-2024098210-A1 ARYL CARBOXYLIC ACID COMPOUND AND USE THEREOF IN PREPARATION OF MRGPR X4 INHIBITOR 深圳博瑞医药科技有限公司 2024-05-16 WO disclosed
CN-115108957-B Synthesis method of chiral 2-phenylpyrrolidine 深圳博瑞医药科技有限公司 2023-12-29 CN disclosed
CN-115108957-A Synthesis method of chiral 2-phenylpyrrolidine 深圳博瑞医药科技有限公司 2022-09-27 CN disclosed
EP-2331499-B1 COLD MENTHOL RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2016-09-21 EP disclosed
EP-2331499-B1 COLD MENTHOL RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2016-09-21 EP disclosed
US-8324217-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2012-12-04 US disclosed
US-8324217-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2012-12-04 US disclosed
US-20120136006-A1 COLD MENTHOL RECEPTOR ANTAGONISTS COLBURN RAYMOND W (US) 2012-05-31 US disclosed
US-20120136006-A1 COLD MENTHOL RECEPTOR ANTAGONISTS COLBURN RAYMOND W (US) 2012-05-31 US disclosed
US-8143259-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA, NV (BE) 2012-03-27 US disclosed
US-8143259-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA, NV (BE) 2012-03-27 US disclosed
EP-2331499-A1 COLD MENTHOL RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2011-06-15 EP disclosed
WO-2010021878-A1 COLD MENTHOL RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-02-25 WO disclosed
WO-2010021878-A1 COLD MENTHOL RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-02-25 WO disclosed
US-20100048589-A1 Cold Menthol Receptor Antagonists JANSSEN PHARMACEUTICA NV (BE) 2010-02-25 US disclosed
US-20100048589-A1 Cold Menthol Receptor Antagonists JANSSEN PHARMACEUTICA NV (BE) 2010-02-25 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 (2 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-20100048589-A1 Cold Menthol Receptor Antagonists TRPV1, TRPM2, TRPM6 PRMT5 1515/4885WDR77 2626/4885CHRNB2 249/4885
US-20120136006-A1 COLD MENTHOL RECEPTOR ANTAGONISTS TRPV1, TRPM2, TRPM6 PRMT5 1515/4885WDR77 2626/4885CHRNB2 249/4885

“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.