SCHEMBL22609074

SCHEMBL22609074

CCCC[PH](CCCC)(CCCC)CCCC.CS(=O)(=O)O

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.40
CA1 P00915 4/20 0.40
CA12 O43570 2/20 0.39
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39
PPARA Q07869 2/20 0.38
TP53 P04637 2/20 0.37
EPHX1 P07099 7/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.35
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH7 P40394 1/20 0.33
TSHR P16473 1/20 0.33
CA9 Q16790 1/20 0.33
CASP2 P42575 1/20 0.32

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
Bromide SCHEMBL29102634 0.97 CA2 (0.39) CA2CA1CA12CA7CA14
Sulfuric Acid SCHEMBL3698698 0.92 TP53 (0.43) CA2CA1CA12CA7CA14
Sulfuric Acid SCHEMBL7637283 0.90 TP53 (0.41) CA2CA1CA12CA7CA14
Sulfuric Acid SCHEMBL10530617 0.85 TP53 (0.43) CA2CA1PPARATP53EPHX1
Sulfuric Acid SCHEMBL7635917 0.85 TP53 (0.39) CA2CA1CA12CA7CA14
SCHEMBL13043123 0.83 APP (0.41) CA2CA1PPARATP53HTT
SCHEMBL27468628 0.83 APP (0.41) CA2CA1PPARATP53HTT
Sulfuric Acid SCHEMBL20975191 0.83 ALDH1A1 (0.43) CA2CA1CA12CA7CA14
SCHEMBL23647661 0.82 CA2 (0.39) CA2CA1CA12CA7CA14
Sulfuric Acid SCHEMBL17102623 0.82 TP53 (0.40) CA2CA1CA12CA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120022522-A Drug-loaded microneedle, drug-loaded microneedle patch and electrically-controlled drug release microneedle system 成都邦迈医创科技有限公司 2025-05-23 CN claimed
CN-119365631-A Process for preparing alkoxylated 2, 5-dihydrofurans 帝斯曼知识产权资产管理有限公司 2025-01-24 CN claimed
CN-115608416-B Preparation method and application of catalyst for producing caprolactam by liquid-phase Beckmann rearrangement 神马实业股份有限公司 2024-04-30 CN claimed
CN-116096477-A System and process for carbon capture and conversion 伊利诺伊大学评议会 2023-05-09 CN claimed
CN-107810057-B Antifouling oligomerization catalyst system 沙特阿拉伯石油公司 2021-06-04 CN claimed
CN-120022522-A Drug-loaded microneedle, drug-loaded microneedle patch and electrically-controlled drug release microneedle system 成都邦迈医创科技有限公司 2025-05-23 CN disclosed
CN-119365631-A Process for preparing alkoxylated 2, 5-dihydrofurans 帝斯曼知识产权资产管理有限公司 2025-01-24 CN disclosed
CN-118688163-A Method for detecting bridging degree of adhesive 住华科技股份有限公司 2024-09-24 CN disclosed
CN-114773148-B Method for synthesizing 2, 3-dichloro-1, 1-trifluoropropane and 2-chloro-1, 1-trifluoropropene 福建永晶科技股份有限公司 2024-05-28 CN disclosed
CN-115608416-B Preparation method and application of catalyst for producing caprolactam by liquid-phase Beckmann rearrangement 神马实业股份有限公司 2024-04-30 CN disclosed
CN-111117594-B Electrochromic material and electrochromic device based on dynamic metal-ligand complexation 吉林大学 2024-03-26 CN disclosed
CN-117186470-A Flexible barrier hardening film and preparation method thereof 博莫威(嘉兴)新技术有限公司 2023-12-08 CN disclosed
CN-107810057-B Antifouling oligomerization catalyst system 沙特阿拉伯石油公司 2021-06-04 CN disclosed
US-20210063786-A1 OPTICAL DEVICE, MICROLENS ARRAY, AND METHOD OF FABRICATING OPTICAL DEVICE NITTO DENKO CORPORATION (JP) 2021-03-04 US disclosed
US-20210055544-A1 OPTICAL DEVICE AND METHOD OF FABRICATING OPTICAL DEVICE SHINSHU UNIVERSITY (JP) 2021-02-25 US disclosed
CN-112390973-A Optical laminate and flexible display device including the same 株式会社LG化学 2021-02-23 CN disclosed
CN-107452925-B Porous heat-resistant layer composition, separator and electrochemical cell using the same 三星SDI株式会社 2021-01-15 CN disclosed
EP-3734348-A1 OPTICAL ELEMENT, AND METHOD FOR PRODUCING OPTICAL ELEMENT Nitto Denko Corporation (JP) 2020-11-04 EP disclosed
EP-3734347-A1 OPTICAL ELEMENT, MICROLENS ARRAY, AND METHOD FOR PRODUCING OPTICAL ELEMENT Nitto Denko Corporation (JP) 2020-11-04 EP disclosed
CN-105637037-B Conductive composition, conductor, method for forming conductor, and method for producing polymer 三菱化学株式会社 2020-04-14 CN disclosed