SCHEMBL5658594

SCHEMBL5658594

Cc1cc2c(NC(=O)NCc3ccc(OC(F)(F)F)cc3)cccc2nn1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.66
MAPT P10636 4/20 0.55
KDM4E B2RXH2 5/20 0.53
THRB P10828 1/20 0.53
RECQL P46063 1/20 0.53
RAB9A P51151 1/20 0.53
PKM P14618 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49
EPHX2 P34913 1/20 0.45
OPRM1 P35372 1/20 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
SCHEMBL5659449 0.87 MAPT (0.73) TRPV1MAPTKDM4ETHRBRECQL
SCHEMBL5659046 0.84 TRPV1 (0.68) TRPV1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL4019943 0.83 TRPV1 (0.71) TRPV1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL5658523 0.81 TRPV1 (0.68) TRPV1KDM4ERECQLMEN1ALDH1A1
SCHEMBL5438048 0.80 TRPV1 (0.61) TRPV1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL5657569 0.80 TRPV1 (0.68) TRPV1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL4020661 0.79 TRPV1 (1.00) TRPV1MAPTKDM4ETHRBRECQL
SCHEMBL5441567 0.76 TRPV1 (0.65) TRPV1
SCHEMBL5442638 0.76 CLK4 (0.70) TRPV1
SCHEMBL5657813 0.76 TRPV1 (0.85) TRPV1KDM4EMEN1ALDH1A1KMT2A

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 37/4885MAPT 4195/4885KDM4E 3121/4885

“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.