SCHEMBL2432001

SCHEMBL2432001

CCOC(=O)c1ccc(NC(=O)NCCC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CASR P41180 9/20 1.00
MAPT P10636 5/20 0.66
NAMPT P43490 1/20 0.66
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
ALDH1A1 P00352 4/20 0.60
HTT P42858 2/20 0.60
KDM4E B2RXH2 1/20 0.60
GAA P10253 2/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
CASP3 P42574 1/20 0.55
TRPV1 Q8NER1 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
ALOX12 P18054 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
SCHEMBL2434317 0.87 CASR (0.81) CASRMAPTNAMPTMEN1KMT2A
SCHEMBL2430084 0.83 CASR (1.00) CASRMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL2430546 0.83 CASR (0.76) CASRMAPTMEN1KMT2AHTT
SCHEMBL1019967 0.81 SMN1; SMN2 (0.78) CASRMAPTNAMPTMEN1KMT2A
SCHEMBL2434172 0.80 CASR (1.00) CASRMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL20380337 0.80 NAMPT (1.00) CASRMAPTNAMPTMEN1KMT2A
SCHEMBL20379660 0.79 CASR (0.65) CASRMAPTNAMPTMEN1KMT2A
SCHEMBL4945166 0.79 CASR (0.65) CASRMAPTNAMPTMEN1KMT2A
SCHEMBL2433648 0.79 CASR (1.00) CASR
SCHEMBL7655911 0.78 SMN1; SMN2 (0.66) CASRMAPTNAMPTMEN1KMT2A

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
EP-2366698-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor Galapagos SAS (FR) 2011-09-21 EP disclosed
US-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor GALAPAGOS SAS (FR) 2008-05-29 US disclosed
US-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor GALAPAGOS SAS (FR) 2008-05-29 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-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor UTS2R, CASR, GPR17 CASR 2/4885MAPT 1435/4885NAMPT 1833/4885

“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.