SCHEMBL17840323

SCHEMBL17840323

CN1CCCC1CCN(C(=O)O)c1ccccc1-c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 18/20 0.56
CYP3A4 P08684 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
GMNN O75496 1/20 0.47
LMNA P02545 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
KMT2A Q03164 1/20 0.47
SLC22A1 O15245 1/20 0.46
MLNR O43193 1/20 0.46
NR1I2 O75469 1/20 0.46
TP53 P04637 1/20 0.46
ADRB2 P07550 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
CHRM5 P08912 1/20 0.46
ADRA2A P08913 1/20 0.46

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
SCHEMBL17797018 0.92 CHRM3 (0.54) CHRM3
SCHEMBL17840336 0.92 CHRM3 (0.58) CHRM3
SCHEMBL17840203 0.90 CHRM3 (0.59) CHRM3
SCHEMBL17840123 0.90 CHRM3 (0.60) CHRM3
SCHEMBL17840171 0.90 CHRM3 (0.56) CHRM3
SCHEMBL17840986 0.89 CHRM3 (0.54) CHRM3CYP3A4SMN1; SMN2MEN1GMNN
SCHEMBL17840987 0.89 CHRM3 (0.54) CHRM3CYP3A4SMN1; SMN2MEN1GMNN
SCHEMBL17840147 0.89 CHRM3 (0.61) CHRM3
SCHEMBL17840070 0.89 CHRM3 (0.59) CHRM3
SCHEMBL17840002 0.88 CHRM3 (0.59) CHRM3DRD1HRH2HTR2AHTR2C

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 2/4885CYP3A4 59/4885SMN1; SMN2 1664/4885

“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.