SCHEMBL6947137

SCHEMBL6947137

Cc1cc(Cl)ccc1C(=C=O)C(=O)Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 3/20 0.44
FLT4 P35916 3/20 0.44
KDR P35968 3/20 0.44
CYP11B2 P19099 1/20 0.43
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 2/20 0.40
GPR27 Q9NS67 1/20 0.39
TSHR P16473 2/20 0.39
CASP1 P29466 1/20 0.39
MYC P01106 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
KCNMA1 Q12791 1/20 0.37
ABL1 P00519 1/20 0.37
USP2 O75604 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
SCHEMBL6559853 0.81 CES2 (0.39) SMN1; SMN2MEN1MAPTKMT2AALDH1A1
SCHEMBL14432141 0.79 GPR27 (0.36) GPR27TSHRMEN1MAPTKMT2A
SCHEMBL4678894 0.78 BCHE (0.33) SMN1; SMN2MAPTKMT2AALDH1A1HPGD
SCHEMBL5745612 0.78 HPGD (0.43) SMN1; SMN2MYCKMT2APOLBHPGD
SCHEMBL107882 0.77 FLT1 (0.51) FLT1FLT4KDRCYP11B2RAB9A
SCHEMBL250256 0.75 FLT1 (0.53) FLT1FLT4KDRCYP11B2RAB9A
SCHEMBL30628195 0.74 FLT1 (0.51) FLT1FLT4KDRCYP11B2RAB9A
SCHEMBL4574528 0.74 FLT1 (0.51) FLT1FLT4KDRCYP11B2RAB9A
SCHEMBL109654 0.74 SMN1; SMN2 (0.63) FLT1FLT4KDRRAB9ASMN1; SMN2
SCHEMBL11535595 0.74 CES2 (0.50) TSHRMAPTALOX15ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1119559-B1 3-PHENYL-PYRONES BAYER CROPSCIENCE AG (DE) 2003-11-26 EP disclosed
US-6441030-B1 PESTICIDES, FUNGICIDES AND HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed
EP-1119559-A1 3-PHENYL-PYRONES Bayer Aktiengesellschaft (DE) 2001-08-01 EP disclosed
WO-2000021946-A1 3-PHENYL-PYRONES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-20 WO disclosed