SCHEMBL14307653

SCHEMBL14307653

CC1(C)C(=O)Nc2cc3[nH]c(-c4c(NCC(O)c5cccc(Cl)c5)cc[nH]c4=O)nc3cc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.65
CYP3A4 P08684 15/20 0.65
CYP2C19 P33261 10/20 0.65
CYP1A2 P05177 9/20 0.65
CYP2C9 P11712 9/20 0.65
EGFR P00533 2/20 0.56
INSR P06213 2/20 0.56
LCK P06239 2/20 0.56
KDR P35968 2/20 0.56
PTK2 Q05397 2/20 0.56
ERBB2 P04626 1/20 0.56
MET P08581 1/20 0.56
MAP2K1 Q02750 1/20 0.56
PLK4 O00444 1/20 0.56
CHEK1 O14757 1/20 0.56
AURKA O14965 1/20 0.56
PDPK1 O15530 1/20 0.56
DAPK3 O43293 1/20 0.56
DYRK3 O43781 1/20 0.56
JAK2 O60674 1/20 0.56

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
SCHEMBL5131419 1.00 IGF1R (0.65) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL14302115 0.84 IGF1R (0.61) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL5132799 0.84 IGF1R (0.61) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL768089 0.84 IGF1R (0.68) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL768090 0.84 IGF1R (0.68) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL5009115 0.84 IGF1R (0.70) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL5009164 0.81 IGF1R (0.69) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL5008135 0.81 IGF1R (0.66) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL5008138 0.81 IGF1R (0.66) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL768042 0.79 IGF1R (0.66) IGF1RCYP3A4CYP2C19CYP1A2CYP2C9

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
WO-2008022747-A1 TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-02-28 WO disclosed