SCHEMBL1860141

SCHEMBL1860141

Cc1cnc(-c2cnc3c(Nc4ccc(C(F)(F)F)cc4)ccnc3n2)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 11/20 0.53
MAOA P21397 1/20 0.47
KCNH2 Q12809 1/20 0.47
CDK2 P24941 2/20 0.38
GSK3B P49841 1/20 0.38
SGK1 O00141 1/20 0.36
AGPAT2 O15120 1/20 0.35
PTGES O14684 1/20 0.35
MAPK1 P28482 1/20 0.34
MAPK3 P27361 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL1863281 0.88 TRPV1 (0.69) TRPV1MAOAKCNH2MAPK3ALDH1A1
SCHEMBL1866412 0.86 TRPV1 (0.61) TRPV1MAPK3
SCHEMBL1858141 0.86 TRPV1 (0.50) TRPV1MAOAKCNH2CDK2GSK3B
SCHEMBL1865352 0.82 TRPV1 (0.52) TRPV1MAOAKCNH2MAPK3
SCHEMBL1864622 0.77 TRPV1 (0.61) TRPV1MAOAKCNH2MAPK3
SCHEMBL12629653 0.76 TRPV1 (0.80) TRPV1MAOAKCNH2MAPK3
SCHEMBL1856640 0.76 TRPV1 (0.66) TRPV1MAOAKCNH2
SCHEMBL1862098 0.75 TRPV1 (0.49) TRPV1
SCHEMBL1862218 0.74 TRPV1 (0.64) TRPV1MAOAKCNH2MAPK3
SCHEMBL1856617 0.74 TRPV1 (0.66) TRPV1MAOAKCNH2MAPK3

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 549/4885MAOA 582/4885KCNH2 2767/4885

“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.