SCHEMBL31009554

SCHEMBL31009554

O=C1CCc2ccc(-c3ccccc3)nc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 3/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 5/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 3/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP1A2 P05177 2/20 0.38
MAP2K3 P46734 1/20 0.37
ASIC3 Q9UHC3 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
XDH P47989 1/20 0.35
FEN1 P39748 1/20 0.35
USP30 Q70CQ3 1/20 0.34

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
SCHEMBL10271343 0.90 KMT2A (0.49) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL883086 0.90 KMT2A (0.53) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL28600177 0.79 NPY5R (0.49) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL6256544 0.78 KMT2A (0.38) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL28538237 0.77 MEN1 (0.42) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL21849539 0.77 ALDH1A1 (0.47) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL20081509 0.76 KDM4E (0.43) KMT2AMEN1RAB9AALDH1A1KDM4E
SCHEMBL21098271 0.73 PARP1 (0.43) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL27708952 0.72 CLK4 (0.49) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL11643793 0.71 GRM5 (0.45) KMT2AL3MBTL1MEN1RAB9AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058449-A Method for synthesizing pyrido cyclic alcohol chiral compound by asymmetric catalytic hydrogenation 安徽凯泰莱铂科技有限公司 2025-05-30 CN disclosed
CN-112979650-B Organic compound and organic electroluminescent device containing the same 北京鼎材科技有限公司 2024-08-13 CN disclosed