SCHEMBL7252808

SCHEMBL7252808

Cc1ccc(C(=O)O)c(NC(=O)c2ccc(Cl)cc2Cl)c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.82
PPARA Q07869 1/20 0.82
RAB9A P51151 5/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
NPC1 O15118 3/20 0.68
TP53 P04637 2/20 0.65
MAPT P10636 2/20 0.61
TSHR P16473 1/20 0.56
CASP1 P29466 1/20 0.56
LMNA P02545 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
PKM P14618 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
FLT1 P17948 1/20 0.52
FLT4 P35916 1/20 0.52
KDR P35968 1/20 0.52
HDAC1 Q13547 1/20 0.52

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
SCHEMBL18644316 0.90 PPARG (1.00) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL1308769 0.90 PPARG (0.69) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL14363391 0.83 PPARG (0.66) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL2891026 0.82 PPARG (0.68) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL13964448 0.82 HDAC1 (0.72) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL1307242 0.82 PPARG (0.81) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL2270596 0.81 ACLY (0.70) PPARGPPARAMEN1KMT2AKDM4E
SCHEMBL11604086 0.80 CLCN2 (0.61) PPARGPPARARAB9ASMN1; SMN2NPC1
SCHEMBL1308314 0.79 GRIK1 (0.69) PPARGPPARASMN1; SMN2MAPTLMNA
SCHEMBL2681276 0.79 RAB9A (0.69) PPARGPPARARAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 WO claimed