SCHEMBL2120899

SCHEMBL2120899

COc1cccc(N(CC(=O)N2CCN(Cc3ccccc3)CC2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
HTT P42858 4/20 0.66
SMN1; SMN2 Q16637 1/20 0.60
MAPT P10636 2/20 0.60
LMNA P02545 3/20 0.59
USP2 O75604 2/20 0.59
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
MEN1 O00255 2/20 0.55
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.54
PKM P14618 1/20 0.54
OXTR P30559 1/20 0.54
AVPR1A P37288 1/20 0.54
KDM4E B2RXH2 1/20 0.53
SIGMAR1 Q99720 1/20 0.52

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
SCHEMBL1899873 0.83 HTT (0.68) KMT2AHTTSMN1; SMN2LMNAUSP2
SCHEMBL571757 0.82 ALDH1A1 (0.69) KMT2AHTTSMN1; SMN2LMNAUSP2
SCHEMBL30774057 0.79 TP53 (0.67) KMT2AHTTSMN1; SMN2MAPTLMNA
SCHEMBL1895427 0.79 TP53 (0.67) KMT2AHTTSMN1; SMN2MAPTLMNA
SCHEMBL9320657 0.77 MEN1 (0.83) KMT2ASMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL23386775 0.77 HTT (0.57) KMT2AHTTSMN1; SMN2MAPTLMNA
SCHEMBL14878167 0.76 KMT2A (0.61) KMT2AHTTSMN1; SMN2MAPTLMNA
SCHEMBL7148075 0.76 BCHE (0.55) KMT2AHTTMAPTLMNAMEN1
SCHEMBL5059902 0.75 ALDH1A1 (0.78) KMT2AHTTSMN1; SMN2MAPTLMNA
SCHEMBL1629905 0.73 KEAP1 (0.76)

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-20120094964-A1 SULFAMOYL BENZOIC ACID DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2012-04-19 US disclosed
US-20120094964-A1 SULFAMOYL BENZOIC ACID DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2012-04-19 US disclosed
US-20120094964-A1 SULFAMOYL BENZOIC ACID DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2012-04-19 US disclosed
WO-2010125831-A1 SULFAMOYL BENZOIC ACID DERIVATIVES AS TRPM8 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2010-11-04 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-20120094964-A1 SULFAMOYL BENZOIC ACID DERIVATIVES AS TRPM8 ANTAGONISTS TRPM8, TRPM5, TRPM6 KMT2A 941/4885HTT 2818/4885SMN1; SMN2 1501/4885

“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.