SCHEMBL6090896

SCHEMBL6090896

CN(C)Cc1c(C=O)[nH]c2c1CCCC2

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 15/20 0.39
PDGFRB P09619 3/20 0.35
FGFR1 P11362 3/20 0.35
KDR P35968 3/20 0.35
LCK P06239 2/20 0.35
FYN P06241 2/20 0.35
YES1 P07947 2/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 2/20 0.35
GLA P06280 2/20 0.35
GAA P10253 2/20 0.35
ALOX15 P16050 1/20 0.34
LMNA P02545 1/20 0.32
PPARG P37231 1/20 0.32
NCOR2 Q9Y618 1/20 0.32

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
SCHEMBL14560398 0.84 SRC (0.47) SRCPDGFRBFGFR1KDRLCK
SCHEMBL6405511 0.82 SRC (0.56) SRCPDGFRBFGFR1KDRLCK
SCHEMBL6696760 0.81 SRC (0.55) SRCPDGFRBFGFR1KDRLCK
SCHEMBL14560397 0.77 SRC (0.41) SRCPDGFRBFGFR1KDRLCK
SCHEMBL6405608 0.74 SRC (0.44) SRCPDGFRBFGFR1KDRLCK
SCHEMBL14560400 0.73 SRC (0.38) SRCPDGFRBFGFR1KDRLCK
SCHEMBL6797512 0.73 SRC (0.39) SRCPDGFRBFGFR1KDRLCK
SCHEMBL6692238 0.72 SRC (0.38) SRCPDGFRBFGFR1KDRLCK
SCHEMBL5829815 0.72 SRC (0.55) SRCPDGFRBFGFR1KDRLCK
SCHEMBL14560396 0.72 SRC (0.47) SRCPDGFRBFGFR1KDRLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP disclosed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO disclosed