SCHEMBL31444879

SCHEMBL31444879

CC1CCN(C(=O)OC(C)(C)C)c2nc(Cl)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
GPR119 Q8TDV5 5/20 0.38
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37

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
SCHEMBL4243711 0.86 GPR119 (0.43) GPR119GRM5KDM1A
SCHEMBL4253538 0.81 GPR119 (0.35) GPR119ALDH1A1PTPN2PTPN1PTPN6
SCHEMBL4244018 0.78 L3MBTL1 (0.39) MEN1KMT2AHPGDNPSR1HSD17B10
SCHEMBL31446045 0.77 HTR2A (0.39) STSMEN1KMT2ALMNAPOLB
SCHEMBL12654612 0.75 ESR2 (0.41) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL30133442 0.75 ESR2 (0.41) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL1808364 0.74 ESR2 (0.41) MEN1KMT2ALMNAPOLBGPR119
SCHEMBL30168967 0.74 ESR2 (0.41) MEN1KMT2ALMNAPOLBGPR119
SCHEMBL31445013 0.74 BUB1 (0.38) STSMEN1KMT2ALMNAPOLB
SCHEMBL21767554 0.73 PDK1 (0.39) STSKMT2ALMNAPOLBNPC1

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-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed