SCHEMBL25438243

SCHEMBL25438243

CC(C)(C)C(=O)[C@H](Cc1ccccc1Cl)NC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KCNJ6 P48051 1/20 0.40
KCNJ5 P48544 1/20 0.40
KCNJ3 P48549 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MAPT P10636 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
ANPEP P15144 1/20 0.40
HIF1A Q16665 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL14347555 0.84 NPC1 (0.41) CNR1SMN1; SMN2PPARGPPARAALDH1A1
SCHEMBL16501745 0.84 NPC1 (0.41) CNR1SMN1; SMN2PPARGPPARAALDH1A1
SCHEMBL22427640 0.80 L3MBTL1 (0.50) NPSR1NPC1RAB9AMAPT
SCHEMBL18422575 0.77 LMNA (0.50) CNR1SMN1; SMN2PPARGPPARAALDH1A1
SCHEMBL25436650 0.76 PPARG (0.40) CNR1SMN1; SMN2PPARGPPARAALDH1A1
SCHEMBL2152925 0.75 TNF (0.50) SMN1; SMN2PPARGPPARAALDH1A1NPC1
SCHEMBL6377776 0.75 TNF (0.50) SMN1; SMN2PPARGPPARAALDH1A1NPC1
SCHEMBL27479477 0.75 TNF (0.50) SMN1; SMN2PPARGPPARAALDH1A1NPC1
SCHEMBL20272568 0.74 PPARG (0.49) SMN1; SMN2PPARGPPARAALDH1A1NPC1
SCHEMBL31370388 0.74 PPARG (0.49) SMN1; SMN2PPARGPPARAALDH1A1NPC1

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-2023107597-A2 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO disclosed