SCHEMBL4359659

SCHEMBL4359659

CC(=O)c1ccc(Nc2cc(COCC(C)C)nc3nc(-c4ncccc4Cl)ccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.36
NPC1 O15118 3/20 0.36
GUSB P08236 1/20 0.36
TRPV1 Q8NER1 5/20 0.35
KDM4E B2RXH2 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
RXFP1 Q9HBX9 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.32
NR1H4 Q96RI1 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TP53 P04637 2/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL4356951 0.89 TRPV1 (0.49) TRPV1
SCHEMBL4353574 0.89 TRPV1 (0.40) MAPTNPC1TRPV1KDM4EHTT
SCHEMBL13936306 0.88 TRPV1 (0.41) TRPV1
SCHEMBL4353295 0.87 TRPV1 (0.50) TRPV1
SCHEMBL5102263 0.79 TRPV1 (0.39) MAPTNPC1TRPV1MEN1KMT2A
SCHEMBL4356605 0.78 TRPV1 (0.54) TRPV1
SCHEMBL4351469 0.78 TRPV1 (0.53) TRPV1
SCHEMBL4360169 0.78 TRPV1 (0.62) TRPV1
SCHEMBL4361090 0.77 TRPV1 (0.46) TRPV1
SCHEMBL4351808 0.77 TRPV1 (0.43) TRPV1

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-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-20050070547-A1 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION 2005-03-31 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-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES PIGS, HRH4, GPR52 MAPT 3260/4885NPC1 2272/4885GUSB 2260/4885
US-20050070547-A1 Substituted quinolin-4-ylamine analogues PIGS, HRH4, GPR52 MAPT 3260/4885NPC1 2092/4885GUSB 2146/4885

“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.