SCHEMBL9895995

SCHEMBL9895995

COc1ccc(CCNS(=O)(=O)c2ccc3ccccc3c2)cc1OC

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.75
ALDH1A1 P00352 3/20 0.68
POLB P06746 1/20 0.65
SMN1; SMN2 Q16637 2/20 0.64
PDE4D Q08499 1/20 0.63
SFRP1 Q8N474 1/20 0.62
LMNA P02545 1/20 0.60
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA5A P35218 1/20 0.59
CA9 Q16790 1/20 0.59
CA14 Q9ULX7 1/20 0.59
CYP19A1 P11511 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
TPSAB1 Q15661 1/20 0.56

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
SCHEMBL29259793 0.86 ALDH1A1 (0.74) ALDH1A1POLBSMN1; SMN2CA12CA1
SCHEMBL5960056 0.86 HTT (1.00) HTTALDH1A1POLBSMN1; SMN2SFRP1
SCHEMBL7416728 0.83 HTT (0.76) HTTALDH1A1POLBSMN1; SMN2PDE4D
SCHEMBL5960103 0.82 ALDH1A1 (0.79) HTTALDH1A1POLBSMN1; SMN2SFRP1
SCHEMBL6104071 0.82 HTT (0.81) HTTALDH1A1POLBSMN1; SMN2SFRP1
SCHEMBL508554 0.81 ALDH1A1 (0.77) HTTALDH1A1POLBSMN1; SMN2PDE4D
SCHEMBL9927443 0.80 TPSAB1 (0.67) ALDH1A1POLBCYP19A1TPSAB1
SCHEMBL4618123 0.80 SFRP1 (0.84) HTTALDH1A1POLBSMN1; SMN2SFRP1
SCHEMBL16863964 0.79 TPSAB1 (0.59) HTTALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL9895381 0.78 TPSAB1 (0.65) ALDH1A1POLBCYP19A1TPSAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRANSPOSAGEN BIOPHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRANSPOSAGEN BIOPHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRANSPOSAGEN BIOPHARMACEUTICALS, INC. (US) 2012-06-14 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-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRPC4, TRPC1, TRPC3 HTT 1242/4885ALDH1A1 4359/4885POLB 4356/4885

“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.