SCHEMBL18125282

SCHEMBL18125282

Cc1ccc(B2OC(C)(C)C(C)(C)O2)cc1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 13/20 0.46
▸ LIPG Q9Y5X9 13/20 0.46
▸ HIF1A Q16665 2/20 0.43
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA3 P07451 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA6 P23280 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ F11 P03951 1/20 0.41
▸ TSHR P16473 1/20 0.39
▸ CASP1 P29466 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
SCHEMBL822504 0.85 HIF1A (0.46) LPLLIPGHIF1ACA1CA2
SCHEMBL14217299 0.82 LPL (0.50) LPLLIPGHIF1ACA1CA2
SCHEMBL1284346 0.81 CA1 (0.46) LPLLIPGHIF1ACA1CA2
SCHEMBL10208083 0.80 LPL (0.44) LPLLIPGHIF1ACA1CA2
SCHEMBL12496719 0.80 LPL (0.51) LPLLIPGHIF1ACA1CA2
SCHEMBL17421143 0.79 LPL (0.47) LPLLIPGCA1CA2CA9
SCHEMBL3690091 0.78 LPL (0.46) LPLLIPGCA1CA2CA9
SCHEMBL2640296 0.78 LPL (0.53) LPLLIPGCA1CA2CA9
SCHEMBL32663644 0.78 LPL (0.46) LPLLIPGCA1CA2CA9
SCHEMBL20108471 0.78 LPL (0.46) LPLLIPGHIF1ACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12195490-B2 STRAD-binding agents and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-14 — — US disclosed
CN-115916966-A STRAD binding agents and uses thereof 加利福尼亚大学董事会 2023-04-04 — — CN disclosed
CN-111094300-B Benzo-heteroaryl derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2022-09-16 — — CN disclosed
WO-2021155004-A1 STRAD-BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-08-05 — — WO disclosed
CN-111094300-A Benzo-heteroaryl derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2020-05-01 — — CN disclosed
US-20180179167-A1 Nrf2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-06-28 — — US disclosed
US-20180179167-A1 Nrf2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-06-28 — — US disclosed
US-20180179167-A1 Nrf2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-06-28 — — US disclosed
EP-3307719-A1 NRF2 REGULATORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-04-18 — — EP disclosed
US-20180086699-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-03-29 — — US disclosed
US-9856214-B2 EBNA1 inhibitors and their method of use THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2018-01-02 — — US disclosed
WO-2016203400-A1 NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-12-22 — — WO disclosed
WO-2016203400-A1 NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-12-22 — — WO disclosed
US-20160289185-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-10-06 — — 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 (4 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-20160289185-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE MCM5, EBNA1BP2, MLLT1 LPL 2839/4885LIPG 3129/4885HIF1A 2472/4885
US-20180179167-A1 Nrf2 REGULATORS NFE2L2, KEAP1, NQO1 LPL 1579/4885LIPG 1137/4885HIF1A 329/4885
US-12195490-B2 STRAD-binding agents and uses thereof STRAP, STRA6, PLAUR LPL 1132/4885LIPG 180/4885HIF1A 1777/4885
US-20180086699-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE EBNA1BP2, MLLT1, PML LPL 2159/4885LIPG 2743/4885HIF1A 2452/4885

“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.

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