SCHEMBL7473364

SCHEMBL7473364

CCOC(=O)Cc1ccc(NCCC=C2C(=O)Nc3cc(OC)c(OC)cc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RET P07949 6/20 0.47
MAPT P10636 2/20 0.41
TLK2 Q86UE8 3/20 0.39
BRD4 O60885 1/20 0.39
GSK3B P49841 2/20 0.39
NOX4 Q9NPH5 1/20 0.38
CHEK1 O14757 1/20 0.37
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
FLT3 P36888 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
PAK1 Q13153 1/20 0.36

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
SCHEMBL7474781 0.89 RET (0.50) RETTLK2BRD4GSK3BNOX4
SCHEMBL7472918 0.82 RET (0.54) RETTLK2BRD4GSK3BNOX4
SCHEMBL7480965 0.82 RET (0.45) RETTLK2BRD4GSK3BFLT4
SCHEMBL6332669 0.81 RET (0.47) RETMAPTTLK2BRD4GSK3B
SCHEMBL7475213 0.80 RET (0.43) RETMAPTTLK2BRD4GSK3B
SCHEMBL7475792 0.79 RET (0.48) RETTLK2BRD4
SCHEMBL7475417 0.78 RET (0.44) RETTLK2BRD4GSK3BNOX4
SCHEMBL7474241 0.78 RET (0.42) RETTLK2BRD4GSK3BALDH1A1
SCHEMBL7473409 0.78 TLK2 (0.44) RETTLK2BRD4GSK3BCHEK1
SCHEMBL7476920 0.78 RET (0.45) RETTLK2BRD4GSK3BNOX4

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-1212318-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS Boehringer Ingelheim Pharma KG (DE) 2002-06-12 EP disclosed
WO-2001016130-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-03-08 WO disclosed