SCHEMBL29294345

SCHEMBL29294345

OBOc1ccc(N(c2ccc(-c3ccccc3)cc2)c2cccc3oc4ccccc4c23)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.32
▸ PTPN1 P18031 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ L3MBTL1 Q9Y468 5/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ NQO1 P15559 1/20 0.30
▸ MAOB P27338 1/20 0.30
▸ CDC14B O60729 1/20 0.30
▸ CDC14A Q9UNH5 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ PLA2G2A P14555 1/20 0.30
▸ PLA2G4A P47712 1/20 0.30
▸ ATM Q13315 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
SCHEMBL22966119 0.86 PLA2G2A (0.38) PTPN1LMNAMAOAKDM4EALDH1A1
SCHEMBL17721433 0.86 PLA2G2A (0.38) PTPN1LMNAMAOAKDM4EALDH1A1
SCHEMBL14295628 0.86 PLA2G2A (0.38) PTPN1LMNAMAOAKDM4EALDH1A1
SCHEMBL22966120 0.85 PLA2G2A (0.37) PTPN1LMNAMAOAKDM4EALDH1A1
SCHEMBL17737642 0.83 PLA2G2A (0.38) PTPN1LMNAMAOAKDM4EALDH1A1
SCHEMBL14295627 0.83 TNKS (0.36) PTPN1MAOAL3MBTL1KDM4EALDH1A1
SCHEMBL21203342 0.81 PGR (0.39) L3MBTL1CYP3A4NPC1RAB9APLA2G2A
SCHEMBL22255534 0.81 PGR (0.39) L3MBTL1CYP3A4NPC1RAB9APLA2G2A
SCHEMBL22255528 0.81 PGR (0.39) L3MBTL1CYP3A4NPC1RAB9APLA2G2A
SCHEMBL21214775 0.81 CDC14B (0.35) MAOAKDM4EALDH1A1CYP3A4HSD17B10

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
US-20240237518-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2024-07-11 — — US disclosed
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