SCHEMBL17840302

SCHEMBL17840302

CN1CC[C@@H](CN(C(=O)O)c2ccc(Cl)cc2-c2cccc(Cl)c2)C1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 12/20 0.56
L3MBTL1 Q9Y468 1/20 0.43
CHRM1 P11229 2/20 0.39
MCHR1 Q99705 1/20 0.39

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
SCHEMBL17840303 1.00 CHRM3 (0.56) CHRM3L3MBTL1CHRM1MCHR1
SCHEMBL17840214 0.92 CHRM3 (0.58) CHRM3
SCHEMBL17840291 0.92 CHRM3 (0.58) CHRM3
SCHEMBL17840213 0.92 CHRM3 (0.58) CHRM3
SCHEMBL17840218 0.92 CHRM3 (0.56) CHRM3L3MBTL1CHRM1
SCHEMBL17840284 0.92 CHRM3 (0.56) CHRM3L3MBTL1CHRM1
SCHEMBL17840220 0.92 CHRM3 (0.56) CHRM3L3MBTL1CHRM1
SCHEMBL17840982 0.89 CHRM3 (0.50) CHRM3L3MBTL1
SCHEMBL17840983 0.89 CHRM3 (0.50) CHRM3L3MBTL1
SCHEMBL17840054 0.87 CHRM3 (0.58) CHRM3

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-9828339-B2 Biphenyl derivatives and methods for preparing same DONG-A ST CO., LTD (KR) 2017-11-28 US disclosed
US-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG-A ST CO., LTD (KR) 2016-06-23 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-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME CHRM2, CHRM3, CHRM5 CHRM3 2/4885L3MBTL1 3460/4885CHRM1 5/4885

“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.