SCHEMBL1948673

SCHEMBL1948673

O=S(=O)([O-])c1cccc2ccccc12.O=S(=O)([O-])c1cccc2ccccc12.[Ba+2]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
F2 P00734 3/20 0.55
PRSS1 P07477 3/20 0.55
PRSS2 P07478 3/20 0.55
PRSS3 P35030 3/20 0.55
HTR6 P50406 2/20 0.55
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HCRTR1 O43613 1/20 0.45
TSHR P16473 2/20 0.44
AKR1B1 P15121 1/20 0.44
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SCN1A P35498 1/20 0.42

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
SCHEMBL5684924 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL4888590 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL4889621 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL11801187 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL295200 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL4886341 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
Potassium Ion SCHEMBL1305040 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
Potassium Ion SCHEMBL10962719 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
Zinc Ion SCHEMBL1683962 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1
SCHEMBL4882439 0.96 CA1 (0.61) CA1CA2CA9F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023143543-A1 MAINTENANCE METHOD AND MAINTENANCE OIL FOR CIRCUIT BREAKER AND KNIFE SWITCH 覃东明 2023-08-03 WO claimed
CN-112694934-B Gear oil composition and preparation method thereof 中国石油化工股份有限公司 2022-07-15 CN claimed
CN-112760161-B Anhydrous calcium-based lubricating grease and preparation method thereof 中国石油化工股份有限公司 2022-07-15 CN claimed
CN-112694927-B Anti-rust oil composition and preparation method thereof 中国石油化工股份有限公司 2022-07-15 CN claimed
CN-112760161-A Anhydrous calcium-based lubricating grease and preparation method thereof 中国石油化工股份有限公司 2021-05-07 CN claimed
CN-112694934-A Gear oil composition and preparation method thereof 中国石油化工股份有限公司 2021-04-23 CN claimed
CN-112694927-A Anti-rust oil composition and preparation method thereof 中国石油化工股份有限公司 2021-04-23 CN claimed
CN-109777539-A A kind of alcohol-based fuel compound additive and the preparation method and application thereof 钱丰 2019-05-21 CN claimed
CN-109762679-A A kind of high-purity agent for carbon hydrogen detergent of environment-friendly type and preparation method thereof 中山市浩科化工科技有限公司 2019-05-17 CN claimed
CN-109161426-A A kind of preparation method of the shock proof hydraulic oil of high-efficiency abrasion-proof 苏州功业肆点零智能科技有限公司 2019-01-08 CN claimed
CN-106590876-A Power-assisted steering oil composition 辽宁润迪汽车环保科技股份有限公司 2017-04-26 CN claimed
CN-106519880-A High-permeability water-repellent aircraft preservative 中国民用航空总局第二研究所 2017-03-22 CN claimed
CN-106497650-A Special tail seal grease of shield of a kind of shield machine and preparation method thereof 中国石油化工股份有限公司 2017-03-15 CN claimed
CN-106085096-A A kind of based on amino resins creep into drilling rod protective coating and preparation method thereof 吴舒晨 2016-11-09 CN claimed
CN-106046872-A Microcrystalline graphite-tannin extract composite aqueous Dacromet coating liquid and preparation method thereof 合肥和安机械制造有限公司 2016-10-26 CN claimed
CN-102776055-B Industrial gear oil SHANGHAI FUDAO CHEMICAL TECHNOLOGY DEV CO LTD 2013-11-13 CN claimed
CN-102776055-A Industrial gear oil SHANGHAI FUDAO CHEMICAL TECHNOLOGY DEV CO LTD 2012-11-14 CN claimed
CN-102260576-A Steam turbine oil 2011-11-30 CN claimed
CN-101538501-A Composite synthetic air compressor oil SHANGHAI HIRI LUBRICATE MATERI 2009-09-23 CN claimed
CN-1071691-A LUBRICATING COMPOSITION NANFANG POWER MACHINERY CO MIN (CN) 1993-05-05 CN claimed