SCHEMBL30952911

SCHEMBL30952911

CCOC(=O)c1nc2cc3c(cc2cc1N)OCO3

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
SMN1; SMN2 Q16637 5/20 0.51
HSD17B10 Q99714 5/20 0.51
MAPT P10636 5/20 0.51
NPC1 O15118 4/20 0.51
RXFP1 Q9HBX9 3/20 0.51
TSHR P16473 2/20 0.51
ALDH1A1 P00352 8/20 0.49
HPGD P15428 7/20 0.49
KDM4E B2RXH2 4/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
TP53 P04637 2/20 0.49
RAB9A P51151 5/20 0.46
ALOX15 P16050 2/20 0.46
ATM Q13315 2/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL24961545 1.00 LMNA (0.56) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL23625904 0.84 LMNA (0.39) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL24823387 0.83 NPC1 (0.46) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL30311035 0.83 NPC1 (0.46) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL24824154 0.83 NPC1 (0.46) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL30310925 0.83 NPC1 (0.46) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL24823308 0.82 ALDH1A1 (0.40) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL6014247 0.82 LMNA (0.53) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL23625902 0.80 LMNA (0.48) LMNATDP1SMN1; SMN2HSD17B10MAPT
SCHEMBL24826088 0.80 KDM4E (0.41) LMNASMN1; SMN2HSD17B10MAPTNPC1

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-113767090-B Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-05-28 CN disclosed