SCHEMBL27360985

SCHEMBL27360985

c1ccc(-c2oc3c(-c4ccccc4)c(-c4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc4)c4ccccc4c3c2-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.43
ALDH1A1 P00352 5/20 0.40
HSD17B10 Q99714 3/20 0.40
ALOX15 P16050 1/20 0.40
HPGD P15428 4/20 0.38
KDM4E B2RXH2 3/20 0.38
UBE2N P61088 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PLA2G2A P14555 1/20 0.38
PLA2G4A P47712 1/20 0.38
BCL9 O00512 2/20 0.36
CTNNB1 P35222 2/20 0.36
DDR2 Q16832 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PTGS2 P35354 2/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
GSK3B P49841 1/20 0.35

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
SCHEMBL12425505 0.92 TNK2 (0.38) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL22954037 0.90 TNK2 (0.43) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL12425495 0.87 ALDH1A1 (0.37) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL12425506 0.87 PTGS2 (0.41) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL2620727 0.84 TNK2 (0.46) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL12425496 0.83 ALDH1A1 (0.33) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL12425493 0.82 PTGS2 (0.38) ALDH1A1HSD17B10HPGDKDM4ESMN1; SMN2
SCHEMBL12425492 0.82 CYP1A1 (0.38) ALDH1A1HSD17B10HPGDKDM4ESMN1; SMN2
SCHEMBL22414869 0.79 ALDH1A1 (0.42) TNK2ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL29597624 0.79 ALDH1A1 (0.42) TNK2ALDH1A1HSD17B10ALOX15HPGD

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
WO-2024005431-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-04 WO disclosed
WO-2024005428-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-04 WO disclosed