SCHEMBL7477387

SCHEMBL7477387

COc1cc2c(cc1OC)/C(=C(\Nc1ccc(CC(=O)O)cc1)c1ccccc1)C(=O)N2

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.50
NR1H4 Q96RI1 7/20 0.46
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
FFAR1 O14842 2/20 0.42
GLA P06280 1/20 0.42
FABP4 P15090 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39

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
SCHEMBL5784560 1.00 RET (0.50) RETNR1H4KDM4EPOLBTP53
SCHEMBL5784552 1.00 RET (0.50) RETNR1H4KDM4EPOLBTP53
SCHEMBL7476044 0.92 RET (0.48) RETNR1H4KDM4EPOLBMAPT
SCHEMBL5784962 0.92 RET (0.48) RETNR1H4KDM4EPOLBMAPT
SCHEMBL5784953 0.92 RET (0.48) RETNR1H4KDM4EPOLBMAPT
SCHEMBL5783058 0.91 RET (0.47) RETNR1H4KDM4EMEN1KMT2A
SCHEMBL5783053 0.91 RET (0.47) RETNR1H4KDM4EMEN1KMT2A
SCHEMBL5783077 0.90 RET (0.48) RETPOLBMAPTMEN1KMT2A
SCHEMBL7474780 0.90 RET (0.48) RETPOLBMAPTMEN1KMT2A
SCHEMBL5783080 0.90 RET (0.48) RETPOLBMAPTMEN1KMT2A

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