SCHEMBL2349154

SCHEMBL2349154

O=C(Nc1ccc(OC(F)(F)F)cc1)c1cccc2c1OCCN2c1ncccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 4/20 0.47
MAPT P10636 3/20 0.45
KDR P35968 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
PTGS2 P35354 1/20 0.43
ABL1 P00519 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
MALT1 Q9UDY8 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CRHBP P24387 1/20 0.41
KMT2A Q03164 1/20 0.41
CRHR2 Q13324 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
RAB9A P51151 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
SCHEMBL2347697 0.91 DHODH (0.48) P2RY1MAPTKDRABL1L3MBTL1
SCHEMBL2348490 0.91 P2RY1 (0.47) P2RY1MAPTKDRABL1L3MBTL1
SCHEMBL2351440 0.90 P2RY1 (0.47) P2RY1MAPTKDRABL1L3MBTL1
SCHEMBL2343172 0.89 P2RY1 (0.48) P2RY1MAPTKDRABL1L3MBTL1
SCHEMBL14540807 0.89 L3MBTL1 (0.43) MAPTTDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL2345220 0.89 L3MBTL1 (0.55) MAPTPTGS2L3MBTL1NPC1SMN1; SMN2
SCHEMBL1548784 0.89 TRPV1 (0.49) MAPTHTTSMN1; SMN2KMT2ATRPV1
SCHEMBL1549375 0.88 P2RY1 (0.46) P2RY1MAPTKDRABL1L3MBTL1
SCHEMBL1548738 0.88 KDM4E (0.50) MAPTL3MBTL1NPC1HTTSMN1; SMN2
SCHEMBL2344360 0.88 P2RY1 (0.47) P2RY1MAPTKDRABL1L3MBTL1

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 P2RY1 124/4885MAPT 4135/4885KDR 482/4885

“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.