SCHEMBL4032925

SCHEMBL4032925

Cc1noc(-c2cccc(CCl)c2)c1N(C(=O)O)C(C)c1ccccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.42
LPAR2 Q9HBW0 2/20 0.42
LPAR3 Q9UBY5 2/20 0.42
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.36
PTGES O14684 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
SCD5 Q86SK9 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
RORC P51449 1/20 0.33
AOC3 Q16853 1/20 0.33

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
SCHEMBL4030608 0.90 LPAR1 (0.42) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4034499 0.89 LPAR1 (0.48) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4033623 0.88 LPAR1 (0.41) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4031244 0.88 LPAR1 (0.43) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4035115 0.88 IP6K1 (0.40) LPAR1LPAR2LPAR3TP53MAPT
SCHEMBL4035057 0.88 TP53 (0.41) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4034108 0.88 LPAR1 (0.44) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4036926 0.88 LPAR1 (0.46) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4030964 0.87 HDAC3 (0.39) LPAR1LPAR2LPAR3MEN1KMT2A
SCHEMBL4033684 0.83 NPC1 (0.39) LPAR1LPAR2LPAR3MEN1KMT2A

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
EP-1258484-B1 NOVEL ISOXAZOLE AND THIAZOLE COMPOUNDS AND USE THEREOF AS DRUGS KYOWA HAKKO KIRIN CO LTD (JP) 2009-01-14 EP claimed