SCHEMBL20407032

SCHEMBL20407032

N=C(/N=C(\N)c1ccccc1)c1cc2ccccc2cc1-c1ccc(COc2ccccc2N)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.40
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ RXRG P48443 1/20 0.37
▸ F2 P00734 4/20 0.36
▸ F10 P00742 4/20 0.35
▸ F9 P00740 3/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ MRGPRX4 Q96LA9 1/20 0.35
▸ C5AR1 P21730 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 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
SCHEMBL20407095 0.84 APP (0.48) APPF2F10F9PARP1
SCHEMBL23655242 0.83 APP (0.34) APP
SCHEMBL20404917 0.81 GRIN2B (0.43) APPRXRARXRBRXRGF10
SCHEMBL20405155 0.78 HDAC3 (0.32) MAPT
SCHEMBL20405131 0.78 LTB4R2 (0.32) —
SCHEMBL23655127 0.75 PLAU (0.34) F2F10GAA
SCHEMBL20404992 0.73 CYP11B1 (0.42) F2PARP1
SCHEMBL20404885 0.72 APP (0.52) APPRXRARXRBRXRGALDH1A1
SCHEMBL24914261 0.72 GRIN2B (0.36) APPF2F10F9MRGPRX4
SCHEMBL24914173 0.71 APP (0.37) APPF2F10F9MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3351537-B1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2023-01-18 — — EP disclosed
EP-3351536-B1 ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2021-07-21 — — EP disclosed
EP-3351537-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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