SCHEMBL26550759

SCHEMBL26550759

Nc1ccc(-c2cccc3c2oc2c4ccccc4ccc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 2/20 0.56
▸ PIK3CB P42338 1/20 0.44
▸ PIK3CG P48736 1/20 0.44
▸ PRKCZ Q05513 1/20 0.44
▸ ARSA P15289 1/20 0.42
▸ CDC25A P30304 1/20 0.42
▸ CDC25C P30307 1/20 0.42
▸ CYP1A1 P04798 8/20 0.41
▸ CYP1B1 Q16678 8/20 0.41
▸ ABCG2 Q9UNQ0 2/20 0.41
▸ MITF O75030 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CYP1A2 P05177 7/20 0.40

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
SCHEMBL25655313 0.85 HSD17B10 (0.50) PRKDCPIK3CBPIK3CGPRKCZMITF
SCHEMBL30760715 0.85 PRKDC (0.47) PRKDCPIK3CBCYP1A1CYP1B1ABCG2
SCHEMBL26117842 0.85 PRKDC (0.47) PRKDCPIK3CBCYP1A1CYP1B1ABCG2
SCHEMBL17382979 0.84 ARSA (0.42) PRKDCARSACDC25ACDC25CCYP1A1
SCHEMBL31534638 0.84 ARSA (0.42) PRKDCARSACDC25ACDC25CCYP1A1
SCHEMBL18644796 0.84 CYP1A1 (0.56) PRKDCARSACDC25ACDC25CCYP1A1
SCHEMBL15481641 0.83 HSD17B10 (0.54) PRKDCPIK3CBPIK3CGPRKCZMITF
SCHEMBL17382982 0.83 ARSA (0.41) PRKDCARSACDC25ACDC25CCYP1A1
SCHEMBL17167459 0.83 CYP1A1 (0.54) PRKDCCYP1A1CYP1B1ABCG2ALDH1A1
SCHEMBL17943892 0.83 CYP1A1 (0.46) PRKDCARSACDC25ACDC25CCYP1A1

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-2023195787-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 머티어리얼사이언스 주식회사 2023-10-12 — — WO disclosed
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