SCHEMBL2937336

SCHEMBL2937336

CC1(C)C(=O)N(c2ccc(C(F)(F)F)cc2S)C(=O)N1Cc1ccnc(NC(=O)CN2CCN(c3ccccn3)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
LMNA P02545 4/20 0.53
HSD17B10 Q99714 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TSHR P16473 3/20 0.51
MAPT P10636 2/20 0.51
IGF1R P08069 5/20 0.46
GAA P10253 1/20 0.45
DRD2 P14416 3/20 0.44
DRD4 P21917 3/20 0.44
DRD3 P35462 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALOX12 P18054 1/20 0.44
THRB P10828 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL2936413 0.93 IGF1R (0.45) ALDH1A1LMNAHSD17B10L3MBTL1TSHR
SCHEMBL2995898 0.89 IGF1R (0.51) ALDH1A1IGF1R
SCHEMBL2937335 0.84 IGF1R (0.68) ALDH1A1LMNAHSD17B10L3MBTL1IGF1R
SCHEMBL2938349 0.84 IGF1R (0.47) MAPTIGF1RGAANPSR1
SCHEMBL2933343 0.84 IGF1R (0.50) LMNAMAPTIGF1R
SCHEMBL2943419 0.83 IGF1R (0.55) IGF1R
SCHEMBL2939986 0.83 IGF1R (0.49) IGF1R
SCHEMBL2938067 0.82 IGF1R (0.50) IGF1R
SCHEMBL19410398 0.82 KMT2A (0.45) ALDH1A1LMNAHSD17B10L3MBTL1TSHR
SCHEMBL2939573 0.82 IGF1R (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1599464-B1 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2010-09-22 EP disclosed