SCHEMBL31483006

SCHEMBL31483006

CC(C)[C@H](CO)NC(N)=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.38
CNR1 P21554 2/20 0.35
TGFBR1 P36897 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CAD P27708 1/20 0.32
CNR2 P34972 1/20 0.32
KMT2A Q03164 3/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 2/20 0.30
HTT P42858 1/20 0.30
MEN1 O00255 2/20 0.30
ECE1 P42892 1/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30

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
SCHEMBL31483112 1.00 PAX8 (0.38) PAX8CNR1TGFBR1NPC1ALDH1A1
SCHEMBL4330718 0.80 CNR1 (0.36) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL16648831 0.78 CNR1 (0.39) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL11069078 0.78 MAPT (0.42) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL16348942 0.78 MAPT (0.42) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL4341764 0.78 MEN1 (0.38) PAX8CNR1CA1CA2CA7
SCHEMBL1120240 0.78 CNR1 (0.39) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL14350678 0.78 MAPT (0.42) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL1261511 0.78 CNR1 (0.39) PAX8CNR1TGFBR1ALDH1A1CA1
SCHEMBL25159573 0.77 PAX8 (0.36) PAX8CNR1CA1CA2CA7

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
CN-119841829-A Compounds for the treatment of PI3K gamma mediated diseases and uses thereof 中国科学院合肥物质科学研究院 2025-04-18 CN disclosed