SCHEMBL24550600

SCHEMBL24550600

Clc1cccc2oc3cc4nc(-c5ccc6oc7ccccc7c6c5)sc4cc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 3/20 0.42
▸ MAPT P10636 6/20 0.37
▸ ALDH1A1 P00352 6/20 0.37
▸ HPGD P15428 5/20 0.37
▸ POLB P06746 4/20 0.37
▸ THRB P10828 1/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ TTR P02766 1/20 0.36
▸ APP P05067 2/20 0.35
▸ RAB9A P51151 5/20 0.34
▸ KDM4E B2RXH2 5/20 0.34
▸ NPC1 O15118 4/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ PKM P14618 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ TDP1 Q9NUW8 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
SCHEMBL24550528 0.96 AHR (0.42) AHRMAPTALDH1A1HPGDPOLB
SCHEMBL24550854 0.88 APP (0.36) MAPTALDH1A1HPGDPOLBAPP
SCHEMBL24550619 0.87 SMN1; SMN2 (0.44) MAPTALDH1A1HPGDPOLBTHRB
SCHEMBL22884597 0.86 MAPT (0.48) MAPTALDH1A1HPGDPOLBTHRB
SCHEMBL24552142 0.83 APP (0.36) MAPTALDH1A1HPGDPOLBAPP
SCHEMBL24551346 0.83 KDM4E (0.42) MAPTALDH1A1HPGDPOLBCTDSP1
SCHEMBL24550455 0.82 SMN1; SMN2 (0.44) MAPTALDH1A1HPGDPOLBTHRB
SCHEMBL24550847 0.82 MAPT (0.36) MAPTALDH1A1HPGDPOLBTHRB
SCHEMBL24550599 0.79 AHR (0.40) AHRMAPTALDH1A1TTRKMT2A
SCHEMBL25584853 0.79 AHR (0.56) AHRMAPTALDH1A1HPGDTTR

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
WO-2022131869-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-23 — — WO disclosed
Send feedback