SCHEMBL6090960

SCHEMBL6090960

CCOC(=O)c1ccc(C=C2C(=O)NN=C2OC(C)C)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.38
LMNA P02545 2/20 0.36
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 2/20 0.34
ABL1 P00519 1/20 0.34
RET P07949 1/20 0.34
PDGFRB P09619 1/20 0.34
FGFR1 P11362 1/20 0.34
FLT3 P36888 1/20 0.34
ALK Q9UM73 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34

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
SCHEMBL6090957 1.00 KDR (0.38) KDRLMNAMEN1KMT2AMAPT
SCHEMBL6090727 0.85 LRRK2 (0.34) KMT2ALRRK2
SCHEMBL6090722 0.85 LRRK2 (0.34) KMT2ALRRK2
SCHEMBL6088079 0.80 ALDH1A1 (0.35) KDRMEN1KMT2AMAPTLRRK2
SCHEMBL6088075 0.80 ALDH1A1 (0.35) KDRMEN1KMT2AMAPTLRRK2
SCHEMBL6091255 0.80 PDPK1 (0.40) KDRKMT2AMAPTTDP1LRRK2
SCHEMBL6091251 0.80 PDPK1 (0.40) KDRKMT2AMAPTTDP1LRRK2
SCHEMBL6090524 0.79 PDPK1 (0.43) KMT2AMAPTLRRK2POLBRAB9A
SCHEMBL6090528 0.79 PDPK1 (0.43) KMT2AMAPTLRRK2POLBRAB9A
SCHEMBL6091408 0.78 KDR (0.38) KDRLMNAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP claimed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO claimed
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