SCHEMBL4924397

SCHEMBL4924397

NCc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 7/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
CNR2 P34972 11/20 0.60
CXCR3 P49682 1/20 0.58
CNR1 P21554 3/20 0.57
MAPT P10636 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
SCHEMBL14068257 0.85 TAS2R14 (0.63) TAS2R14MEN1KMT2ACNR2CXCR3
SCHEMBL984791 0.85 TAS2R14 (0.71) TAS2R14MEN1KMT2ACNR2CXCR3
SCHEMBL4243334 0.84 BACE1 (0.71) TAS2R14MEN1KMT2ACNR2CXCR3
SCHEMBL4917430 0.83 CNR2 (0.68) TAS2R14MEN1KMT2ACNR2CNR1
SCHEMBL4741416 0.81 TAS2R14 (0.62) TAS2R14MEN1KMT2ACNR2CXCR3
SCHEMBL14025440 0.81 ALDH1A1 (0.56) TAS2R14MEN1KMT2ACNR2CNR1
SCHEMBL4413527 0.81 HTR2A (0.75) TAS2R14MEN1KMT2ACNR2CXCR3
SCHEMBL8911635 0.81 TAS2R14 (0.78) TAS2R14MEN1KMT2ACNR2CNR1
SCHEMBL10929983 0.81 SERPINE1 (0.51) TAS2R14CNR2MAPT
SCHEMBL1278788 0.80 TAS2R14 (0.97) TAS2R14MEN1KMT2ACXCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013130943-A1 ALKYL-AND DI-SUBSTITUTED AMIDO-BENZYL SULFONAMIDE DERIVATIVES GENENTECH, INC. (US) 2013-09-06 WO disclosed
US-20080261978-A1 treating or preventing HIV infections, and in treating proliferative disorders such as inhibiting the metastasis of various cancers; 1-(4-((pyridin-2-ylmethylamino)methyl)benzyl)-3-phenylurea METASTATIX, INC. 2008-10-23 US disclosed
US-20080261978-A1 treating or preventing HIV infections, and in treating proliferative disorders such as inhibiting the metastasis of various cancers; 1-(4-((pyridin-2-ylmethylamino)methyl)benzyl)-3-phenylurea METASTATIX, INC. 2008-10-23 US disclosed
US-20080261978-A1 treating or preventing HIV infections, and in treating proliferative disorders such as inhibiting the metastasis of various cancers; 1-(4-((pyridin-2-ylmethylamino)methyl)benzyl)-3-phenylurea METASTATIX, INC. 2008-10-23 US disclosed
WO-2008109154-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS, INC. (US) 2008-09-12 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-20080261978-A1 treating or preventing HIV infections, and in treating proliferative disorders such as inhibiting the metastasis of various cancers; 1-(4-((pyridin-2-ylmethylamino)methyl)benzyl)-3-phenylurea MKI67, CCNI, CDKN1A TAS2R14 4808/4885MEN1 173/4885KMT2A 682/4885

“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.