SCHEMBL904776

SCHEMBL904776

COC(=O)c1ccc(S(=O)(=O)NCc2cnc3ccccc3c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
FAAH O00519 2/20 0.52
ALPL P05186 2/20 0.51
CYP1A2 P05177 1/20 0.50
NAMPT P43490 2/20 0.48
CYP19A1 P11511 1/20 0.47
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 1/20 0.46
BCAT1 P54687 1/20 0.46
PTGES O14684 1/20 0.45
ALOX5 P09917 1/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX12 P18054 1/20 0.44
PLAU P00749 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
SCHEMBL904715 0.86 POLB (0.62) POLBNAMPTCYP19A1ALOX15HTT
SCHEMBL1868959 0.83 CYP1A2 (0.57) POLBALPLCYP1A2CYP19A1RAB9A
SCHEMBL904705 0.80 POLB (0.52) POLBNAMPTCYP19A1HTTKMT2A
SCHEMBL119461 0.79 POLB (0.72) POLBCYP1A2NAMPTCYP19A1TSHR
SCHEMBL3850206 0.77 POLB (0.72) POLBCYP1A2NAMPTHTTTSHR
SCHEMBL117881 0.76 POLB (0.55) POLBNAMPTCYP19A1HTTTSHR
SCHEMBL28884689 0.76 HDAC8 (0.52) POLBFAAHALPLCYP1A2ALOX15
SCHEMBL19616555 0.74 HDAC6 (0.72) FAAHALPLALOX15HTTRAB9A
SCHEMBL904743 0.74 POLB (0.55) POLBNAMPTCYP19A1HTTRAB9A
SCHEMBL12078573 0.74 KDR (0.65) NAMPTRAB9AKDM4EALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829026-B2 Sulfamoyl benzoic acid heterobicyclic derivatives as TRPM8 antagonists RAQUALIA PHARMA INC. (JP) 2014-09-09 US disclosed
US-8829026-B2 Sulfamoyl benzoic acid heterobicyclic derivatives as TRPM8 antagonists RAQUALIA PHARMA INC. (JP) 2014-09-09 US disclosed
US-8829026-B2 Sulfamoyl benzoic acid heterobicyclic derivatives as TRPM8 antagonists RAQUALIA PHARMA INC. (JP) 2014-09-09 US disclosed
US-20130210858-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2013-08-15 US disclosed
US-20130210858-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2013-08-15 US disclosed
US-20130210858-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2013-08-15 US disclosed
WO-2012042915-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2012-04-05 WO disclosed
WO-2012042915-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2012-04-05 WO 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-20130210858-A1 SULFAMOYL BENZOIC ACID HETEROBICYCLIC DERIVATIVES AS TRPM8 ANTAGONISTS TRPM8, TRPM6, TRPM5 POLB 4408/4885FAAH 729/4885ALPL 4789/4885

“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.