SCHEMBL29754378

SCHEMBL29754378

COc1c(C(N)=O)cc(C(=O)NC2CCCCC2)c(S(N)(=O)=O)c1CCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.50
CNR2 P34972 5/20 0.50
CA12 O43570 4/20 0.47
CA2 P00918 4/20 0.47
CA6 P23280 4/20 0.47
CA7 P43166 4/20 0.47
CA9 Q16790 4/20 0.47
CA13 Q8N1Q1 4/20 0.47
CA1 P00915 3/20 0.47
CA4 P22748 3/20 0.47
CA5A P35218 3/20 0.47
CA14 Q9ULX7 3/20 0.47
CA5B Q9Y2D0 3/20 0.47
DVL1 O14640 3/20 0.47
DVL3 Q92997 3/20 0.47
SGMS2 Q8NHU3 1/20 0.45
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL18041117 0.67 ALDH1A1 (0.69) SGMS2KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL9812825 0.66 NPC1 (0.54) CA12CA2CA6CA7CA9
SCHEMBL4229605 0.66 NPC1 (0.65) KMT2AALDH1A1RAB9AMEN1HPGD
SCHEMBL11236668 0.66 RAB9A (0.71) SGMS2KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL15942792 0.66 MEN1 (0.57) CNR1CNR2SGMS2KMT2AALDH1A1
SCHEMBL30876857 0.65 NPC1 (0.66) CA12CA2CA6CA7CA9
SCHEMBL874583 0.65 NPC1 (0.66) CA12CA2CA6CA7CA9
SCHEMBL13978402 0.64 NPC1 (0.62) CA12CA2CA6CA7CA9
SCHEMBL31670543 0.64 CA12 (1.00) CA12CA2CA6CA7CA9
SCHEMBL18425872 0.64 CA12 (1.00) CA12CA2CA6CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11376229-B2 Method of treating or preventing neurodegeneration REPRISE PHARMACEUTICALS, INC. (US) 2022-07-05 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-11376229-B2 Method of treating or preventing neurodegeneration TRPM4, TRPM5, TRPM2 CNR1 829/4885CNR2 493/4885CA12 3617/4885

“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.