SCHEMBL878783

SCHEMBL878783

O=Cc1cccc(C2CCCN2C(=O)C(Nc2ccccc2F)c2cc3ccccc3s2)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 13/20 0.36
RIPK1 Q13546 1/20 0.35
HSD17B2 P37059 2/20 0.34
MMP13 P45452 2/20 0.34
ADAM10 O14672 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP14 P50281 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
BTK Q06187 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MMP7 P09237 1/20 0.32
MMP12 P39900 1/20 0.32

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
SCHEMBL841463 0.88 ADAM17 (0.37) ADAM17RIPK1HSD17B2MMP13ADAM10
SCHEMBL839987 0.86 ROCK2 (0.40) ADAM17RIPK1HSD17B2L3MBTL1
SCHEMBL840338 0.85 HRH3 (0.37) ADAM17HRH3L3MBTL1
SCHEMBL840730 0.70 OPRM1 (0.43)
SCHEMBL9288414 0.69 RIPK1 (0.40) ADAM17RIPK1MMP13ADAM10MMP2
SCHEMBL840216 0.68 TRPM8 (0.39) ADAM17RIPK1
SCHEMBL9288755 0.68 ROCK2 (0.43) ADAM17RIPK1
SCHEMBL859592 0.68 TRPM8 (0.39) ADAM17RIPK1
SCHEMBL859295 0.66 ROCK2 (0.41) RIPK1
SCHEMBL1937979 0.64 LMNA (0.43) ADAM17RIPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324217-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2012-12-04 US disclosed
US-20120136006-A1 COLD MENTHOL RECEPTOR ANTAGONISTS COLBURN RAYMOND W (US) 2012-05-31 US disclosed
US-8143259-B2 Cold menthol receptor antagonists JANSSEN PHARMACEUTICA, NV (BE) 2012-03-27 US disclosed
US-20100048589-A1 Cold Menthol Receptor Antagonists JANSSEN PHARMACEUTICA NV (BE) 2010-02-25 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 (2 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-20100048589-A1 Cold Menthol Receptor Antagonists TRPV1, TRPM2, TRPM6 ADAM17 4368/4885RIPK1 3006/4885HSD17B2 2470/4885
US-20120136006-A1 COLD MENTHOL RECEPTOR ANTAGONISTS TRPV1, TRPM2, TRPM6 ADAM17 4368/4885RIPK1 3006/4885HSD17B2 2470/4885

“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.