SCHEMBL5633995

SCHEMBL5633995

CC(C)(C)c1ccc(C(=O)NCCc2cccc(OC(F)(F)F)c2)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.57
ESRRG P62508 5/20 0.56
ESRRB O95718 2/20 0.56
CNR1 P21554 1/20 0.55
PPARG P37231 2/20 0.49
PPARD Q03181 2/20 0.49
PPARA Q07869 2/20 0.49
VNN1 O95497 1/20 0.46
MAPK14 Q16539 1/20 0.45
NAMPT P43490 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45

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
SCHEMBL5187149 0.85 ESRRG (0.60) ESRRGESRRBCNR1PPARGPPARD
SCHEMBL5177863 0.79 ESRRG (0.70) TRPV1ESRRGESRRBNPC1RAB9A
SCHEMBL5178683 0.79 CNR1 (0.48) TRPV1CNR1VNN1MAPK14
SCHEMBL5176979 0.78 ESRRG (0.72) ESRRGESRRBCNR1NPC1RAB9A
SCHEMBL3577619 0.78 TRPV1 (0.69) TRPV1CNR1MAPK14NAMPTNPC1
SCHEMBL5178676 0.76 LMNA (0.57) CNR1VNN1MAPK14
SCHEMBL3391028 0.75 TRPV1 (0.65) TRPV1CNR1MAPK14NAMPTRAB9A
SCHEMBL27422506 0.74 CNR1 (0.67) TRPV1CNR1VNN1MAPK14NAMPT
SCHEMBL7643257 0.74 CNR1 (0.63) TRPV1CNR1VNN1MAPK14NAMPT
SCHEMBL5704409 0.74 PPARG (0.62) TRPV1PPARGPPARDPPARAMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7259183-B2 Indole, indazole and indoline derivatives as CETP inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-21 US disclosed
US-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2006-02-09 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-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors CETP, NAT1, MTTP TRPV1 1818/4885ESRRG 3392/4885ESRRB 3563/4885

“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.