SCHEMBL3603012

SCHEMBL3603012

COc1cccc(NCC=C(C)CCC=C(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.48
MTNR1A P48039 3/20 0.48
MTNR1B P49286 3/20 0.48
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL3603010 1.00 TRPV1 (0.48) TRPV1MTNR1AMTNR1BPPARGPPARA
SCHEMBL3593344 0.82 TRPV1 (0.51) TRPV1
SCHEMBL3593347 0.82 TRPV1 (0.51) TRPV1
SCHEMBL3598188 0.81 TRPV1 (0.51) TRPV1
SCHEMBL3793148 0.81 TRPV1 (0.51) TRPV1
SCHEMBL12802069 0.81 TRPV1 (0.46) TRPV1
SCHEMBL8222368 0.80 TRPV1 (0.50) TRPV1
SCHEMBL28570841 0.80 TRPV1 (0.56) TRPV1PPARGPPARATSHR
SCHEMBL8224019 0.79 TRPV1 (0.55) TRPV1TSHR
SCHEMBL3607179 0.78 PPARG (0.46) TRPV1MTNR1APPARGPPARA

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
US-20100041665-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2010-02-18 US disclosed
EP-2057114-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2009-05-13 EP disclosed
WO-2008015240-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2008-02-07 WO 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-20100041665-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS PNMT, PSEN1, SNCA TRPV1 1245/4885MTNR1A 319/4885MTNR1B 295/4885

“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.