SCHEMBL4926437

SCHEMBL4926437

CCNCc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.64
TAS2R14 Q9NYV8 3/20 0.59
CNR1 P21554 5/20 0.58
MAPT P10636 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
CXCR3 P49682 1/20 0.55

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
SCHEMBL4741416 0.91 TAS2R14 (0.62) CNR2TAS2R14CNR1MAPTMEN1
SCHEMBL14025593 0.86 TAS2R14 (0.55) CNR2TAS2R14CNR1MAPTMEN1
SCHEMBL14025406 0.85 CNR2 (0.53) CNR2TAS2R14CNR1MAPTMEN1
SCHEMBL14025446 0.84 CA12 (0.65) CNR2TAS2R14MAPTMEN1KMT2A
SCHEMBL27312087 0.83 LMNA (0.60) CNR2CNR1
SCHEMBL4743380 0.83 TAS2R14 (0.54) CNR2TAS2R14MAPTMEN1KMT2A
SCHEMBL4786730 0.82 CXCR3 (0.58) CNR2TAS2R14CNR1MAPTMEN1
SCHEMBL15229050 0.80 MAPT (0.69) CNR2TAS2R14MAPTMEN1KMT2A
SCHEMBL4918682 0.80 NAMPT (0.67) TAS2R14MEN1KMT2A
SCHEMBL4917430 0.80 CNR2 (0.68) CNR2TAS2R14CNR1MAPTMEN1

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-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 CNR2 4124/4885TAS2R14 4808/4885CNR1 3440/4885

“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.