SCHEMBL7474780

SCHEMBL7474780

CCOC(=O)Cc1ccc(N/C(=C2/C(=O)Nc3cc(OC)c(OC)cc32)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.48
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KLK7 P49862 1/20 0.39
RECQL P46063 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 1/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL5783077 1.00 RET (0.48) RETMEN1KMT2AHTTMAPT
SCHEMBL5783080 1.00 RET (0.48) RETMEN1KMT2AHTTMAPT
SCHEMBL7477387 0.90 RET (0.50) RETMEN1KMT2AMAPTBCHE
SCHEMBL5784560 0.90 RET (0.50) RETMEN1KMT2AMAPTBCHE
SCHEMBL5784552 0.90 RET (0.50) RETMEN1KMT2AMAPTBCHE
SCHEMBL5783058 0.88 RET (0.47) RETMEN1KMT2ABCHEACHE
SCHEMBL5783053 0.88 RET (0.47) RETMEN1KMT2ABCHEACHE
SCHEMBL7476044 0.88 RET (0.48) RETMEN1KMT2AMAPTRXFP1
SCHEMBL5784962 0.88 RET (0.48) RETMEN1KMT2AMAPTRXFP1
SCHEMBL5784953 0.88 RET (0.48) RETMEN1KMT2AMAPTRXFP1

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