SCHEMBL19742850

SCHEMBL19742850

CCN(C)C=Nc1cc(C)c(Oc2cccc(Oc3ccc(Cl)c(C(F)(F)F)c3)c2C(F)(F)F)cc1C

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.34
AR P10275 6/20 0.33
HTR2A P28223 2/20 0.32
SLC6A4 P31645 2/20 0.32
KCNH2 Q12809 2/20 0.32
S1PR1 P21453 1/20 0.32
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
PLA2G7 Q13093 3/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
RAF1 P04049 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A3 Q01959 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL157046 0.93 SCN9A (0.38) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL121354 0.93 SCN9A (0.38) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL1278450 0.93 SCN9A (0.38) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL29485704 0.93 SCN9A (0.38) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL3302720 0.88 SCN9A (0.39) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL3302723 0.88 SCN9A (0.39) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL12710196 0.85 SCN9A (0.37) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL22176889 0.84 RAF1 (0.37) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL20521116 0.84 RAF1 (0.37) SCN9AARHTR2ASLC6A4KCNH2
SCHEMBL20521115 0.84 RAF1 (0.37) SCN9AARHTR2ASLC6A4KCNH2

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-3237395-B1 CYCLIC COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM BASF SE (DE) 2019-08-07 EP disclosed
US-10023563-B2 Cyclic compounds substituted by a condensed ring system BASF SE (DE) 2018-07-17 US disclosed
US-20170369479-A1 CYCLIC COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM BASF SE (DE) 2017-12-28 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-10023563-B2 Cyclic compounds substituted by a condensed ring system CYCS, DDT, CAT SCN9A 2305/4885AR 3151/4885HTR2A 4668/4885
US-20170369479-A1 CYCLIC COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM CYCS, DDT, CAT SCN9A 2305/4885AR 3151/4885HTR2A 4668/4885

“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.