SCHEMBL6174880

SCHEMBL6174880

CC(c1ccnc2c(N(C)C)cccc12)C1NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 13/20 0.36
LMNA P02545 1/20 0.33
TRPV4 Q9HBA0 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NTRK1 P04629 2/20 0.30

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
SCHEMBL6174980 0.88 IGF1R (0.36) IGF1RLMNATRPV4NTRK1
SCHEMBL6172540 0.86 IGF1R (0.36) IGF1RLMNA
SCHEMBL6171781 0.86 P2RX3 (0.36) IGF1RLMNA
SCHEMBL6175890 0.86 LMNA (0.39) LMNATRPV4ALDH1A1POLBHTT
SCHEMBL6175589 0.81 IGF1R (0.38) IGF1RLMNA
SCHEMBL6174393 0.80 SMN1; SMN2 (0.43) IGF1RLMNA
SCHEMBL6174668 0.79 IGF1R (0.39) IGF1RTRPV4NTRK1
SCHEMBL6176324 0.78 IGF1R (0.35) IGF1RLMNATRPV4
SCHEMBL6174287 0.78 IGF1R (0.38) IGF1RLMNAALDH1A1
SCHEMBL6173610 0.78 IGF1R (0.37) IGF1RLMNA

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