SCHEMBL2347697

SCHEMBL2347697

O=C(O)c1cccnc1N1CCOc2c(C(=O)Nc3ccc(OC(F)(F)F)cc3)cccc21

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.48
P2RY1 P47900 5/20 0.47
MAPT P10636 4/20 0.45
KDR P35968 1/20 0.45
NPC1 O15118 2/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ABL1 P00519 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL2351440 0.92 P2RY1 (0.47) DHODHP2RY1MAPTKDRNPC1
SCHEMBL2343172 0.92 P2RY1 (0.48) P2RY1MAPTKDRNPC1HTT
SCHEMBL2348490 0.91 P2RY1 (0.47) DHODHP2RY1MAPTKDRNPC1
SCHEMBL2349154 0.91 P2RY1 (0.47) P2RY1MAPTKDRNPC1HTT
SCHEMBL2344360 0.90 P2RY1 (0.47) P2RY1MAPTKDRNPC1HTT
SCHEMBL1549375 0.89 P2RY1 (0.46) P2RY1MAPTKDRNPC1HTT
SCHEMBL2348142 0.89 P2RY1 (0.46) DHODHP2RY1MAPTKDRNPC1
SCHEMBL2350757 0.89 KDR (0.46) DHODHP2RY1MAPTKDRNPC1
SCHEMBL2352514 0.88 P2RY1 (0.45) P2RY1MAPTKDRNPC1HTT
SCHEMBL2347054 0.87 P2RY1 (0.46) P2RY1MAPTKDRABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2314585-B1 Condensed benzamide compounds as inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC (JP) 2012-09-12 EP claimed
US-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY JAPAN TOBACCO INC. (JP) 2006-02-16 US claimed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-8008292-B2 Condensed benzamide compounds and inhibitors of vanilloid receptor subtype 1 (VR1) activity JAPAN TOBACCO INC. (JP) 2011-08-30 US disclosed
US-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY JAPAN TOBACCO INC. (JP) 2006-02-16 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-20060035882-A1 CONDENSED BENZAMIDE COMPOUNDS AND INHIBITORS OF VANILLOID RECEPTOR SUBTYPE 1 (VR1) ACTIVITY TRPV1, TRPV2, TRPA1 DHODH 4419/4885P2RY1 124/4885MAPT 4135/4885

“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.