SCHEMBL2431204

SCHEMBL2431204

CCOC(=O)c1cccc(NC(=S)NCCC(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.66
LMNA P02545 7/20 0.66
HTT P42858 7/20 0.66
ALOX12 P18054 7/20 0.66
CASR P41180 3/20 0.64
ALDH1A1 P00352 8/20 0.62
KMT2A Q03164 8/20 0.62
MEN1 O00255 7/20 0.62
ALPL P05186 3/20 0.62
MAPK1 P28482 1/20 0.62
ALPI P09923 1/20 0.60
ALPG P10696 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
KDM4E B2RXH2 1/20 0.57
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
POLB P06746 2/20 0.53
PKM P14618 1/20 0.53
RAB9A P51151 1/20 0.53
HPGD P15428 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
SCHEMBL2438339 0.90 CASR (0.79) MAPTLMNAHTTALOX12CASR
SCHEMBL2434317 0.89 CASR (0.81) MAPTCASRALDH1A1KMT2AMEN1
SCHEMBL2436352 0.85 CASR (0.77) MAPTLMNAHTTALOX12CASR
SCHEMBL12255328 0.83 SMN1; SMN2 (0.75) MAPTLMNAHTTALOX12ALDH1A1
SCHEMBL14096496 0.79 ALDH1A1 (0.70) MAPTLMNAHTTALOX12ALDH1A1
SCHEMBL2433891 0.79 ALOX12 (0.64) MAPTLMNAHTTALOX12CASR
SCHEMBL2430642 0.78 CASR (1.00) MAPTCASRALDH1A1KMT2AMEN1
SCHEMBL5552521 0.78 SMN1; SMN2 (0.71) MAPTLMNAALDH1A1KMT2AMEN1
SCHEMBL2432001 0.76 CASR (1.00) MAPTHTTALOX12CASRALDH1A1
SCHEMBL6793571 0.76 RAB9A (0.76) MAPTLMNAHTTALDH1A1KMT2A

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
EP-2366698-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor Galapagos SAS (FR) 2011-09-21 EP disclosed
EP-2366698-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor Galapagos SAS (FR) 2011-09-21 EP disclosed
EP-2041103-A2 DERIVATIVES OF UREA AND RELATED DIAMINES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR Galapagos SAS (FR) 2009-04-01 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
US-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor GALAPAGOS SAS (FR) 2008-05-29 US disclosed
WO-2008006625-A2 DERIVATIVES OF UREA AND RELATED DIAMINES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR GALAPAGOS SAS (FR) 2008-01-17 WO disclosed
WO-2008006625-A2 DERIVATIVES OF UREA AND RELATED DIAMINES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR GALAPAGOS SAS (FR) 2008-01-17 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-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor UTS2R, CASR, GPR17 MAPT 1435/4885LMNA 3794/4885HTT 3964/4885

“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.