SCHEMBL6856779

SCHEMBL6856779

O=[N+]([O-])c1ccccc1CSCc1ccccc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.62
TSHR P16473 1/20 0.62
HPGD P15428 1/20 0.56
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
POLB P06746 1/20 0.48
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
RECQL P46063 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ACHE P22303 1/20 0.45
TDP1 Q9NUW8 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
SCHEMBL31481622 1.00 ALDH1A1 (0.62) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL1349897 0.89 ALDH1A1 (0.55) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL3503446 0.88 ALDH1A1 (0.62) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL31481613 0.86 CYP1A2 (0.53) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL6340423 0.84 CYP1A2 (0.54) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL6568661 0.84 ALDH1A1 (0.58) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL2397527 0.84 ALDH1A1 (0.58) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL2397523 0.84 ALDH1A1 (0.58) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL3503445 0.84 ALDH1A1 (0.58) ALDH1A1TSHRHPGDNPC1RAB9A
SCHEMBL19514727 0.82 ALDH1A1 (0.56) ALDH1A1TSHRHPGDNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613769-A Photo-crosslinked hydrogel, preparation method and application thereof, radionuclide preparation and application 上海交通大学 2025-03-14 CN claimed
US-12247089-B2 Photo-coupled synergistically crosslinked hydrogel material and its composition, preparation method, use, product, and preparation kit Zhongshan Guanghe Medical Technology Co., Ltd. (CN) 2025-03-11 US claimed
CN-112062699-B Preparation method of o-aminothiophenol 苏州开元民生科技股份有限公司 2021-02-26 CN claimed
CN-112062699-A Preparation method of o-aminothiophenol 苏州开元民生科技股份有限公司 2020-12-11 CN claimed
US-20200262939-A1 PHOTO-COUPLED SYNERGISTICALLY CROSSLINKED HYDROGEL MATERIAL AND ITS COMPOSITION, PREPARATION METHOD, USE, PRODUCT, AND PREPARATION KIT Zhongshan Guanghe Medical Technology Co., Ltd. (CN) 2020-08-20 US claimed
CN-119613769-B Photo-crosslinked hydrogel, preparation method and application thereof, radionuclide preparation and application 上海交通大学 2025-10-17 CN disclosed
CN-119613769-A Photo-crosslinked hydrogel, preparation method and application thereof, radionuclide preparation and application 上海交通大学 2025-03-14 CN disclosed
CN-119613769-A Photo-crosslinked hydrogel, preparation method and application thereof, radionuclide preparation and application 上海交通大学 2025-03-14 CN disclosed
US-12247089-B2 Photo-coupled synergistically crosslinked hydrogel material and its composition, preparation method, use, product, and preparation kit Zhongshan Guanghe Medical Technology Co., Ltd. (CN) 2025-03-11 US disclosed
CN-113429559-B Six-arm polyethylene glycol derivative with terminal iso-functionalization and preparation method thereof 厦门赛诺邦格生物科技股份有限公司 2024-08-23 CN disclosed
CN-112694608-B Six-arm polyethylene glycol derivative, preparation method and modified biological related substance 厦门赛诺邦格生物科技股份有限公司 2024-07-02 CN disclosed
CN-115010915-B Nitrogen-branched nine-arm polyethylene glycol derivative, preparation method and modified biologically-relevant substance thereof 厦门赛诺邦格生物科技股份有限公司 2024-06-11 CN disclosed
CN-110591079-A Preparation method of monofunctional nonlinear polyethylene glycol 厦门赛诺邦格生物科技股份有限公司 2019-12-20 CN disclosed
US-10434182-B2 Eight-arm polyethylene glycol derivative, production method therefor, and modified bio-related substance thereof XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2019-10-08 US disclosed
US-20180214561-A1 EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2018-08-02 US disclosed
EP-3315531-A1 8-ARM POLYETHYLENE GLYCOL DERIVATIVE, MANUFACTURING METHOD AND MODIFIED BIO-RELATED SUBSTANCE THEREBY Xiamen Sinopeg Biotech Co., Ltd. (CN) 2018-05-02 EP disclosed
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
US-6835534-B2 Chemical functionalization nanolithography THE PENN STATE RESEARCH FOUNDATION 2004-12-28 US disclosed
WO-2003053845-A2 CHEMICAL FUNCTIONALIZATION NANOLITHOGRAPHY PENN STATE RESEARCH FOUNDATION (US) 2003-07-03 WO disclosed
US-20020127491-A1 Chemical functionalization nanolithography PENN STATE RESEARCH FOUNDATION, THE 2002-09-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10434182-B2 Eight-arm polyethylene glycol derivative, production method therefor, and modified bio-related substance thereof MRPL38, ALG8, MRPS18A ALDH1A1 1103/4885TSHR 2869/4885HPGD 3050/4885
US-20180214561-A1 EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF MRPL38, CXCL8, ALG8 ALDH1A1 1061/4885TSHR 2426/4885HPGD 3535/4885
US-12247089-B2 Photo-coupled synergistically crosslinked hydrogel material and its composition, preparation method, use, product, and preparation kit PKN3, JAK3, KIT ALDH1A1 92/4885TSHR 3722/4885HPGD 227/4885
US-20200262939-A1 PHOTO-COUPLED SYNERGISTICALLY CROSSLINKED HYDROGEL MATERIAL AND ITS COMPOSITION, PREPARATION METHOD, USE, PRODUCT, AND PREPARATION KIT PKN3, JAK3, KIT ALDH1A1 92/4885TSHR 3722/4885HPGD 227/4885
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR HDGF, F11, F12 ALDH1A1 1582/4885TSHR 1973/4885HPGD 549/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.