SCHEMBL5659699

SCHEMBL5659699

COc1cc2c(NC(=O)NCc3ccc(C(F)(F)F)cc3)ccc(F)c2cn1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.53
KMT2A Q03164 1/20 0.46
MAPK1 P28482 3/20 0.46
MTOR P42345 2/20 0.46
NAMPT P43490 1/20 0.46
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
POLB P06746 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45
RAF1 P04049 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5658815 0.88 TRPV1 (0.55) TRPV1MAPK1MTORNAMPTMAPT
SCHEMBL5659169 0.86 TRPV1 (0.68) TRPV1KMT2APOLBALDH1A1LMNA
SCHEMBL5661578 0.80 TRPV1 (0.71) TRPV1MTORNAMPT
SCHEMBL6686578 0.76 TRPV1 (0.68) TRPV1KMT2ARAF1ALDH1A1
SCHEMBL5661128 0.76 TRPV1 (0.65) TRPV1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL14014096 0.74 NPC1 (0.52) TRPV1KMT2AMTORNAMPTL3MBTL1
SCHEMBL5657810 0.74 MAPK1 (0.53) TRPV1MAPK1MTORNAMPTATG4B
SCHEMBL5658216 0.74 TRPV1 (0.72) TRPV1KMT2AMAPK1ALDH1A1
SCHEMBL5657625 0.74 TRPV1 (0.68) TRPV1KMT2AALDH1A1
SCHEMBL5659710 0.73 TRPV1 (0.51) TRPV1MAPK1ATG4B

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-7285563-B2 Heteroaromatic urea derivatives as VR-1 receptor modulators for treating pain MERCK SHARP & DOHME LTD. (GB) 2007-10-23 US disclosed
US-20050107388-A1 Heteroaromatic urea derivatives as vr-1receptor modulators for treating pain MERCK SHARP & DOHME LTD. (GB) 2005-05-19 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-20050107388-A1 Heteroaromatic urea derivatives as vr-1receptor modulators for treating pain ARRB1, OPRL1, CNR1 TRPV1 37/4885KMT2A 4465/4885MAPK1 1633/4885

“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.