SCHEMBL6176347

SCHEMBL6176347

O=C1C(Cc2ccsc2)N(Cc2ccncc2)C(=O)N1c1ccc(SC(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 17/20 0.52
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
MEN1 O00255 1/20 0.34
KDM4A O75164 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL2941262 0.79 IGF1R (0.60) IGF1RHCRTR1HCRTR2
SCHEMBL2940771 0.79 IGF1R (0.60) IGF1RHCRTR1HCRTR2
SCHEMBL2940768 0.79 IGF1R (0.60) IGF1RHCRTR1HCRTR2
Trifluoroacetic Acid SCHEMBL3728810 0.77 IGF1R (0.42) IGF1RHDAC6MEN1MAPTKMT2A
SCHEMBL31573040 0.74 IGF1R (0.57) IGF1R
Trifluoroacetic Acid SCHEMBL3726606 0.74 IGF1R (0.54) IGF1RHCRTR1HCRTR2
Trifluoroacetic Acid SCHEMBL3734827 0.74 IGF1R (0.54) IGF1RHCRTR1HCRTR2
SCHEMBL2936591 0.73 IGF1R (0.58) IGF1RHCRTR1HCRTR2
SCHEMBL2936597 0.73 IGF1R (0.58) IGF1RHCRTR1HCRTR2
SCHEMBL6176351 0.71 IGF1R (0.46) IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP disclosed
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO disclosed