SCHEMBL18201517

SCHEMBL18201517

c1ccc(Nc2cc(-c3ccccc3)cc3ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 4/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ HPGD P15428 3/20 0.58
▸ CYP3A4 P08684 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ TP53 P04637 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ ATM Q13315 1/20 0.58
▸ MMP2 P08253 4/20 0.49
▸ MMP9 P14780 4/20 0.49
▸ MMP13 P45452 4/20 0.49
▸ MMP8 P22894 3/20 0.49
▸ MAPT P10636 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ RECQL P46063 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ GLA P06280 1/20 0.48
▸ GAA P10253 1/20 0.48

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
SCHEMBL20987744 0.95 CDC25B (0.52) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL24553530 0.95 CDC25B (0.52) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL26021832 0.84 CDC25B (0.45) CDC25BALDH1A1HPGDCYP3A4HSD17B10
Biphenyl SCHEMBL4619027 0.81 ALDH1A1 (0.88) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL29892417 0.80 ALDH1A1 (0.47) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL29104447 0.80 ALDH1A1 (0.47) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL10136241 0.80 ALDH1A1 (0.47) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL30221995 0.80 ALDH1A1 (0.47) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL21234620 0.80 ALDH1A1 (0.71) CDC25BALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL27919141 0.79 HTR6 (0.42) CDC25BALDH1A1HPGDCYP3A4HSD17B10

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-2022075746-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2022-04-14 — — WO disclosed
WO-2016175533-A2 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2016-11-03 — — WO disclosed
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