SCHEMBL1864901

SCHEMBL1864901

COCc1cc(Nc2ccc(C(F)(F)F)cc2)c2ncc(-c3nc(OC)ccc3C(F)(F)F)nc2n1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 16/20 0.42
ACP1 P24666 1/20 0.35
MAOA P21397 1/20 0.34
KCNH2 Q12809 1/20 0.34
RAB9A P51151 1/20 0.34
PTGES O14684 1/20 0.33

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
SCHEMBL1859164 0.90 TRPV1 (0.51) TRPV1MAOAKCNH2
SCHEMBL13622845 0.87 TRPV1 (0.58) TRPV1
SCHEMBL1866403 0.86 TRPV1 (0.48) TRPV1ACP1RAB9A
SCHEMBL1865447 0.86 TRPV1 (0.42) TRPV1ACP1MAOAKCNH2RAB9A
SCHEMBL1861787 0.78 TRPV1 (0.51) TRPV1MAOAKCNH2
SCHEMBL1862403 0.78 TRPV1 (0.54) TRPV1ACP1
SCHEMBL1862452 0.77 TRPV1 (0.46) TRPV1MAOAKCNH2
SCHEMBL1862128 0.77 MRGPRX4 (0.40) TRPV1MAOAKCNH2RAB9APTGES
SCHEMBL4989164 0.76 TRPV1 (0.56) TRPV1MAOAKCNH2
SCHEMBL1864916 0.76 TRPV1 (0.55) TRPV1MAOAKCNH2

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 549/4885ACP1 2981/4885MAOA 582/4885

“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.