SCHEMBL6173494

SCHEMBL6173494

CC(c1ccnc2cccc(N3CCCCC3)c12)C1NC(=O)N(c2ccc(SC(F)(F)F)cc2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 9/20 0.33
PDE2A O00408 3/20 0.33
LMNA P02545 1/20 0.31
ITGB2 P05107 1/20 0.30
ICAM1 P05362 1/20 0.30
ITGAL P20701 1/20 0.30
TRPV4 Q9HBA0 1/20 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
SCHEMBL6176324 0.86 IGF1R (0.35) IGF1RLMNATRPV4
SCHEMBL6175291 0.85 IGF1R (0.36) IGF1RLMNA
SCHEMBL6174021 0.85 IGF1R (0.36) IGF1RLMNA
SCHEMBL6174916 0.84 IGF1R (0.35) IGF1RPDE2A
SCHEMBL6172540 0.83 IGF1R (0.36) IGF1RPDE2ALMNA
SCHEMBL6175392 0.83 IGF1R (0.36) IGF1RLMNA
SCHEMBL6176192 0.83 P2RX3 (0.36) IGF1RLMNA
SCHEMBL6173968 0.83 IGF1R (0.35) IGF1RPDE2ALMNA
SCHEMBL6171343 0.81 IGF1R (0.36) IGF1RPDE2A
SCHEMBL6176997 0.79 KDM4E (0.42) PDE2ALMNATRPV4

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