SCHEMBL29612101

SCHEMBL29612101

c1ccc2c(c1)ccc1c2oc2ccc3ccccc3c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
KMT2A Q03164 1/20 0.47
HPRT1 P00492 1/20 0.46
IKBKB O14920 1/20 0.45
HPGD P15428 5/20 0.45
KDM4E B2RXH2 4/20 0.45
HSD17B10 Q99714 4/20 0.45
ALDH1A1 P00352 4/20 0.45
CYP1A1 P04798 4/20 0.45
ABCG2 Q9UNQ0 4/20 0.45
CYP1A2 P05177 3/20 0.45
TSHR P16473 3/20 0.45
MAPT P10636 3/20 0.45
CYP1B1 Q16678 3/20 0.45
CYP3A4 P08684 2/20 0.45
MAPK1 P28482 2/20 0.45
HTT P42858 2/20 0.45
PAX8 Q06710 2/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL442615 1.00 L3MBTL1 (0.50) L3MBTL1TDP1KMT2AHPRT1IKBKB
SCHEMBL13789696 0.94 L3MBTL1 (0.52) L3MBTL1TDP1KMT2AHPRT1HPGD
SCHEMBL29020031 0.87 ALDH1A1 (0.50) L3MBTL1TDP1KMT2AHPRT1IKBKB
SCHEMBL11914250 0.86 L3MBTL1 (0.54) L3MBTL1TDP1KMT2AHPRT1HPGD
SCHEMBL13935830 0.86 L3MBTL1 (0.46) L3MBTL1TDP1KMT2AHPRT1IKBKB
SCHEMBL19080445 0.84 TDP1 (0.41) L3MBTL1TDP1KMT2AHPGDKDM4E
SCHEMBL16783381 0.84 L3MBTL1 (0.47) L3MBTL1TDP1KMT2AHPRT1HPGD
SCHEMBL13935799 0.84 L3MBTL1 (0.47) L3MBTL1TDP1KMT2AHPRT1IKBKB
SCHEMBL23031075 0.83 L3MBTL1 (0.41) L3MBTL1TDP1KMT2AIKBKBHPGD
SCHEMBL21335443 0.82 KMT2A (0.44) L3MBTL1KMT2AIKBKBHPGDKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111825364-B Preparation method of environment-friendly naphthalene water reducer 安徽鑫固环保股份有限公司 2022-06-14 CN claimed
CN-118684641-A Organic compound, organic semiconductor device, and electronic device 株式会社半导体能源研究所 2024-09-24 CN disclosed
CN-115087648-B Compound, thermoplastic resin, optical member, and optical lens 三菱化学株式会社 2024-07-02 CN disclosed
WO-2023177072-A1 QUANTUM DOT-LIGAND COMPOUND, AND ELECTROLUMINESCENT DIODE AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2023-09-21 WO disclosed
WO-2022114065-A1 MATERIAL OF PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING, AND PHOTOELECTRIC CONVERSION ELEMENT 日鉄ケミカル&マテリアル株式会社 2022-06-02 WO disclosed