SCHEMBL26661230

SCHEMBL26661230

S=c1cc(-c2ccccc2)oc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.75
▸ CYP1B1 Q16678 4/20 0.63
▸ CYP1A1 P04798 3/20 0.63
▸ CYP1A2 P05177 3/20 0.63
▸ TNKS O95271 2/20 0.62
▸ GABRP O00591 1/20 0.62
▸ GABRD O14764 1/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ CA12 O43570 1/20 0.62
▸ CA1 P00915 1/20 0.62
▸ CA2 P00918 1/20 0.62
▸ TP53 P04637 1/20 0.62
▸ ABCB1 P08183 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ PARP1 P09874 1/20 0.62
▸ ADORA3 P0DMS8 1/20 0.62
▸ AR P10275 1/20 0.62
▸ CYP19A1 P11511 1/20 0.62
▸ GABRA1 P14867 1/20 0.62
▸ HPGD P15428 1/20 0.62

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
SCHEMBL12278200 0.78 PLA2G2A (0.59) MAOBCYP1B1CYP1A1CYP1A2TNKS
Flavone SCHEMBL28248986 0.77 TNKS (1.00) MAOBCYP1B1CYP1A1CYP1A2TNKS
Flavone SCHEMBL31316377 0.77 TNKS (1.00) MAOBCYP1B1CYP1A1CYP1A2TNKS
SCHEMBL7915116 0.77 TNKS (0.62) MAOBCYP1B1TNKSGABRPGABRD
Flavone SCHEMBL18879 0.77 TNKS (1.00) MAOBCYP1B1CYP1A1CYP1A2TNKS
Flavone SCHEMBL30542161 0.77 TNKS (1.00) MAOBCYP1B1CYP1A1CYP1A2TNKS
Flavone SCHEMBL15676601 0.77 TNKS (1.00) MAOBCYP1B1CYP1A1CYP1A2TNKS
SCHEMBL29999620 0.77 TNKS (0.62) MAOBCYP1B1TNKSGABRPGABRD
Flavone SCHEMBL8069086 0.76 TNKS (0.96) MAOBCYP1B1CYP1A1CYP1A2TNKS
Flavone SCHEMBL1660769 0.76 TNKS (0.96) MAOBCYP1B1CYP1A1CYP1A2TNKS

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164950-A Preparation method of chiral alkenyl thioflavonoid derivative and chiral alkenyl thioflavonoid derivative 中国科学院大连化学物理研究所 2024-06-11 — — CN claimed
CN-114853708-B Process for preparing 4-thioflavone compounds from hydroxy chalcone compounds and xanthates 苏州大学 2024-03-19 — — CN claimed
WO-2023225916-A1 METHOD FOR PREPARING 4-THIOFLAVONE COMPOUND FROM HYDROXYCHALCONE COMPOUND AND XANTHATE 苏州大学 2023-11-30 — — WO claimed
CN-115466796-A Detection method and application of mycobacterium tuberculosis 西藏自治区人民政府驻成都办事处医院 2022-12-13 — — CN claimed
CN-115160292-A Synthesis method of 3-perfluoroalkyl thioflavone 河南师范大学 2022-10-11 — — CN claimed
CN-114853708-A Method for preparing 4-thioflavone compound from hydroxychalcone compound and xanthate 苏州大学 2022-08-05 — — CN claimed
CN-114341627-A Nucleic acid detection method and device 李峰 2022-04-12 — — CN claimed
CN-118574610-A AKT3 modulators 乔治穆内公司 2024-08-30 — — CN disclosed
CN-118524833-A AKT3 modulators 乔治穆内公司 2024-08-20 — — CN disclosed
CN-118510502-A AKT3 modulators 乔治穆内公司 2024-08-16 — — CN disclosed
CN-118488956-A AKT3 modulators 乔治穆内公司 2024-08-13 — — CN disclosed
CN-118164950-A Preparation method of chiral alkenyl thioflavonoid derivative and chiral alkenyl thioflavonoid derivative 中国科学院大连化学物理研究所 2024-06-11 — — CN disclosed
CN-118164950-A Preparation method of chiral alkenyl thioflavonoid derivative and chiral alkenyl thioflavonoid derivative 中国科学院大连化学物理研究所 2024-06-11 — — CN disclosed
CN-115160292-A Synthesis method of 3-perfluoroalkyl thioflavone 河南师范大学 2022-10-11 — — CN disclosed
CN-115160292-A Synthesis method of 3-perfluoroalkyl thioflavone 河南师范大学 2022-10-11 — — CN disclosed
CN-114853708-A Method for preparing 4-thioflavone compound from hydroxychalcone compound and xanthate 苏州大学 2022-08-05 — — CN disclosed
CN-114853708-A Method for preparing 4-thioflavone compound from hydroxychalcone compound and xanthate 苏州大学 2022-08-05 — — CN disclosed
CN-114853708-A Method for preparing 4-thioflavone compound from hydroxychalcone compound and xanthate 苏州大学 2022-08-05 — — CN disclosed
CN-114404570-A Novel anti-tumor metastasis polypeptide and application thereof 中国药科大学 2022-04-29 — — CN disclosed
CN-114341627-A Nucleic acid detection method and device 李峰 2022-04-12 — — CN disclosed
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