SCHEMBL27355754

SCHEMBL27355754

c1ccc(-c2c3ccccc3c(-c3coc4c3ccc3ccccc34)c3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ CYP1A2 P05177 6/20 0.41
▸ CYP1A1 P04798 5/20 0.41
▸ CYP1B1 Q16678 5/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ ABCG2 Q9UNQ0 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ ABCC1 P33527 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41

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
SCHEMBL27356744 0.91 MEN1 (0.42) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL11404213 0.86 KMT2A (0.49) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL27356726 0.85 MEN1 (0.45) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL30332826 0.85 HPRT1 (0.50) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL27357003 0.83 MEN1 (0.43) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL27356134 0.81 AHR (0.38) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL27356123 0.80 KDM4E (0.37) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL30302922 0.77 HPRT1 (0.45) KMT2AMEN1POLBPTPN1CYP1A2
SCHEMBL27355776 0.77 ABCG2 (0.52) KMT2ACYP1A2CYP1A1CYP1B1ALDH1A1
SCHEMBL27356737 0.77 GPR84 (0.39) KMT2AMEN1CYP1A2CYP1A1CYP1B1

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-2024005428-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-04 — — WO disclosed
Send feedback