SCHEMBL16677167

SCHEMBL16677167

CCCCN(CC)CC(=O)Nc1c(C)cccc1C

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.78
LMNA P02545 3/20 0.78
SCN3A Q9NY46 3/20 0.78
ALDH1A1 P00352 2/20 0.78
CYP3A4 P08684 1/20 0.78
MAPK1 P28482 1/20 0.78
MC4R P32245 1/20 0.78
SCN4A P35499 1/20 0.78
MC3R P41968 1/20 0.78
HTR3A P46098 1/20 0.78
SCN5A Q14524 1/20 0.78
SCN9A Q15858 1/20 0.78
BLM P54132 2/20 0.76
GAA P10253 1/20 0.76
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
NPSR1 Q6W5P4 2/20 0.56
HPGD P15428 3/20 0.55
TSHR P16473 2/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL21264270 0.97 MAPT (0.74) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21261956 0.96 MAPT (0.72) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL24083458 0.94 MAPT (0.74) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21264265 0.93 MAPT (0.72) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21261951 0.93 MAPT (0.80) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21264312 0.92 MAPT (0.66) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21264151 0.92 LMNA (0.74) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21264244 0.91 LMNA (0.68) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL16709550 0.91 LMNA (0.82) MAPTLMNASCN3AALDH1A1CYP3A4
SCHEMBL21261870 0.91 LMNA (0.72) MAPTLMNASCN3AALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3750870-A1 QUATERNARY AMMONIUM SALT COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF West China Hospital, Sichuan University (CN) 2020-12-16 EP disclosed
US-9492409-B2 Compositions and methods for the treatment of local pain CELLIX BIO PRIVATE LIMITED (IN) 2016-11-15 US disclosed
US-20150119423-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF LOCAL PAIN CELLIX BIO PRIVATE LIMITED (IN) 2015-04-30 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-20150119423-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF LOCAL PAIN TRPV1, SCN3A, OPRK1 MAPT 933/4885LMNA 3273/4885SCN3A 2/4885

“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.