SCHEMBL997974

SCHEMBL997974

O=C(O)NC1CCN(c2ccc(Br)cn2)C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.50
TRPM8 Q7Z2W7 1/20 0.50
CA12 O43570 15/20 0.49
CA1 P00915 15/20 0.49
CA2 P00918 15/20 0.49
CA4 P22748 15/20 0.49
CA7 P43166 15/20 0.49
CA9 Q16790 15/20 0.49
KMT2A Q03164 1/20 0.45
AKR1C3 P42330 1/20 0.45
KCNH2 Q12809 1/20 0.45
MCHR1 Q99705 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
SCHEMBL15206576 1.00 TRPV1 (0.50) TRPV1TRPM8CA12CA1CA2
SCHEMBL15205294 1.00 TRPV1 (0.50) TRPV1TRPM8CA12CA1CA2
SCHEMBL31140038 0.92 AKR1C3 (0.50) TRPV1TRPM8AKR1C3
SCHEMBL1728874 0.92 AKR1C3 (0.50) TRPV1TRPM8AKR1C3
SCHEMBL15205421 0.88 TRPV1 (0.49) TRPV1TRPM8CA12CA1CA2
SCHEMBL15206064 0.88 TRPV1 (0.49) TRPV1TRPM8CA12CA1CA2
SCHEMBL1749349 0.85 CA12 (0.53) TRPV1CA12CA1CA2CA4
SCHEMBL391173 0.85 TRPV1 (0.52) TRPV1TRPM8CA12CA1CA2
SCHEMBL392349 0.85 TRPV1 (0.54) TRPV1TRPM8CA12CA1CA2
SCHEMBL392348 0.85 TRPV1 (0.54) TRPV1TRPM8CA12CA1CA2

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-7867980-B2 Lincosamide derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-11 US disclosed
US-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD 2010-07-22 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-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT SIRT6, LAS1L, MRPS18A TRPV1 616/4885TRPM8 675/4885CA12 3475/4885

“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.