SCHEMBL13619317

SCHEMBL13619317

CC(N)(NC(=O)c1cccc2nc(Nc3ccc(Cl)cc3)oc12)c1ccc(C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERAP1 Q9NZ08 2/20 0.39
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.36
PPARG P37231 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
ABCC1 P33527 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
RORC P51449 2/20 0.36
MAPK14 Q16539 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36
GALK1 P51570 6/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35

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
SCHEMBL12948674 0.91 DRD2 (0.41) ERAP1ABCC1ABCG2MEN1KMT2A
SCHEMBL13619313 0.89 KCNH2 (0.39) ERAP1POLBNR1H4MEN1KMT2A
SCHEMBL13620082 0.87 HDAC1 (0.43) ERAP1NR1H4MEN1KMT2ASMN1; SMN2
SCHEMBL12948806 0.82 GAA (0.51) POLBATMABCC1ABCG2RORC
SCHEMBL13619261 0.80 DHODH (0.39) POLBMEN1KMT2AKDM4E
SCHEMBL10085248 0.80 PTGER4 (0.49)
SCHEMBL12585199 0.80 LMNA (0.41) POLBATMABCC1ABCG2RORC
SCHEMBL12583769 0.79 RAB9A (0.49) POLBABCG2MEN1KMT2ANPC1
SCHEMBL12948785 0.78 DRD2 (0.45) MEN1KMT2AGALK1KDM4E
SCHEMBL988503 0.74 EGFR (0.46) ABCC1ABCG2NPC1RAB9ASMN1; SMN2

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-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 WO disclosed