SCHEMBL29399528

SCHEMBL29399528

Nc1ccc2c(O)cc(S(=O)(=O)O)cc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 5/20 1.00
NSD2 O96028 4/20 1.00
DUSP3 P51452 2/20 1.00
PTPN5 P54829 2/20 1.00
PTPN11 Q06124 2/20 1.00
NT5E P21589 4/20 0.76
CTDSP1 Q9GZU7 1/20 0.64
PRMT1 Q99873 2/20 0.60
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 3/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 1/20 0.51
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLAU P00749 1/20 0.49
CASP7 P55210 1/20 0.46
ENPP2 Q13822 1/20 0.44
SIRT1 Q96EB6 1/20 0.43
GAA P10253 1/20 0.39
PLCG1 P19174 1/20 0.39

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
SCHEMBL11413465 1.00 CASP6 (1.00) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL154124 1.00 CASP6 (1.00) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL4115392 0.98 CASP6 (0.97) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL28912220 0.98 CASP6 (0.97) CASP6NSD2DUSP3PTPN5PTPN11
Water SCHEMBL4869253 0.98 CASP6 (0.97) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL27170421 0.98 CASP6 (0.97) CASP6NSD2DUSP3PTPN5PTPN11
Urea SCHEMBL11492396 0.95 CASP6 (0.91) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL16552797 0.94 CASP6 (0.88) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL9135678 0.90 CASP6 (0.81) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL10597126 0.90 CASP6 (0.81) CASP6NSD2DUSP3PTPN5PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112632548-B Malicious android program detection method and device, electronic equipment and storage medium 北京天融信网络安全技术有限公司 2024-01-23 CN claimed
CN-114117791-A Carbonate rock acidizing fracturing numerical simulation method 西安石油大学 2022-03-01 CN claimed
US-20250223462-A1 ELECTRONIC COMPONENT NIHON PARKERIZING CO., LTD. (JP) 2025-07-10 US disclosed
WO-2025080916-A2 METHOD FOR REVERSIBLE PH-SWING FLOW CELLS FOR CO2 CAPTURE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2025-04-17 WO disclosed
CN-119013434-A Electronic component 日本帕卡濑精株式会社 2024-11-22 CN disclosed
CN-117993492-A Map construction method for electric power communication access network service 合肥创数信息科技有限公司 2024-05-07 CN disclosed
CN-112632548-B Malicious android program detection method and device, electronic equipment and storage medium 北京天融信网络安全技术有限公司 2024-01-23 CN disclosed
WO-2023195439-A1 ELECTRONIC COMPONENT 日本パーカライジング株式会社 2023-10-12 WO disclosed
CN-114539803-A Direct red/direct violet dye compound and preparation method and application thereof 广东省科学院测试分析研究所(中国广州分析测试中心) 2022-05-27 CN disclosed
CN-114117791-A Carbonate rock acidizing fracturing numerical simulation method 西安石油大学 2022-03-01 CN disclosed