SCHEMBL1869133

SCHEMBL1869133

COCc1cc(Nc2ccc(C(F)(F)F)cn2)c2ccc(-c3ncc(C(=O)O)cc3Cl)cc2n1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 15/20 0.48
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
MAOA P21397 1/20 0.37
KCNH2 Q12809 1/20 0.37
MAPK10 P53779 1/20 0.35
RAB9A P51151 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
RPS6KA3 P51812 1/20 0.34

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
SCHEMBL12629686 0.90 TRPV1 (0.45) TRPV1RAB9A
SCHEMBL1858201 0.90 TRPV1 (0.38) TRPV1GAARAB9AMRGPRX4
SCHEMBL1858481 0.87 TRPV1 (0.48) TRPV1POLBGAAMAPK10RAB9A
SCHEMBL1867627 0.87 TRPV1 (0.47) TRPV1POLBGAAMAOAKCNH2
SCHEMBL1864536 0.86 TRPV1 (0.49) TRPV1POLBGAAMAOAKCNH2
SCHEMBL1866320 0.82 TRPV1 (0.59) TRPV1POLBGAAMAOAKCNH2
SCHEMBL1867518 0.79 TRPV1 (0.57) TRPV1
SCHEMBL1862872 0.78 TRPV1 (0.57) TRPV1
SCHEMBL1866290 0.77 TRPV1 (0.38) TRPV1GAARAB9AMRGPRX4
SCHEMBL1862939 0.76 TRPV1 (0.38) TRPV1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935702-B2 Substituted biaryl quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2011-05-03 US disclosed
US-7935702-B2 Substituted biaryl quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2011-05-03 US disclosed
US-7935702-B2 Substituted biaryl quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2011-05-03 US disclosed
US-20060111337-A1 Substituted biaryl quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2006-05-25 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 (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-20060111337-A1 Substituted biaryl quinolin-4-ylamine analogues PIGS, GPR52, GPR174 TRPV1 549/4885POLB 3869/4885GAA 803/4885

“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.