SCHEMBL6691405

SCHEMBL6691405

COc1ccc(F)cc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 1/20 0.45
▸ LIPG Q9Y5X9 1/20 0.45
▸ EGFR P00533 2/20 0.41
▸ NFE2L2 Q16236 2/20 0.37
▸ CXCR2 P25025 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ SLC6A2 P23975 6/20 0.35
▸ SLC6A4 P31645 6/20 0.35
▸ SLC6A3 Q01959 5/20 0.35
▸ HTR2A P28223 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ HTR2B P41595 2/20 0.35
▸ CSF1R P07333 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PIN1 Q13526 3/20 0.33

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
SCHEMBL29686713 1.00 LPL (0.45) LPLLIPGEGFRNFE2L2CXCR2
SCHEMBL2658964 0.87 LPL (0.45) LPLLIPGEGFRNFE2L2CXCR2
SCHEMBL3810020 0.84 CA2 (0.42) LPLLIPGEGFRNFE2L2
SCHEMBL31651983 0.83 LPL (0.40) LPLLIPGEGFRCXCR2
SCHEMBL25357432 0.83 LPL (0.41) LPLLIPGEGFRCXCR2
SCHEMBL14358557 0.83 LPL (0.41) LPLLIPGEGFRCXCR2
SCHEMBL30454415 0.83 LPL (0.41) LPLLIPGEGFRCXCR2
SCHEMBL16049143 0.83 LPL (0.41) LPLLIPGEGFRCXCR2KDM4E
SCHEMBL264121 0.82 LPL (0.39) LPLLIPGEGFRCXCR2KDM4E
SCHEMBL16760910 0.81 CA1 (0.47) EGFRNFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4740948-A1 PHARMACEUTICAL COMPOSITION COMPRISING 1,3-BENZODIOXOLE DERIVATIVE COMPOUND Dong Wha Pharm. Co., Ltd. (KR) 2026-05-13 — — EP disclosed
US-20250059180-A1 1,3-BENZODIOXOLE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME DONG WHA PHARM. CO., LTD. (KR) 2025-02-20 — — US disclosed
WO-2025008783-A1 PHARMACEUTICAL COMPOSITION COMPRISING 1,3-BENZODIOXOLE DERIVATIVE COMPOUND 동화약품주식회사 2025-01-09 — — WO disclosed
EP-4464701-A1 1,3-BENZODIOXOLE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Dong Wha Pharm. Co., Ltd. (KR) 2024-11-20 — — EP disclosed
WO-2023135564-A1 1,3-BENZODIOXOLE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 동화약품주식회사 2023-07-20 — — WO disclosed
US-20210403485-A1 PYRAZOLOPYRIMIDINE DERIVATIVE AS SELECTIVE TRK INHIBITOR SHANDONG LUYE PHARMACEUTICAL CO., LTD. (CN) 2021-12-30 — — US disclosed
WO-2004062661-A1 2-‘5-(5-CARBAMIMIDOYL-1H-HETEROARYL)-6-HYDROXYBIPHENYL-3-YL!- CARBOXYLIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-07-29 — — WO 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 (2 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-20250059180-A1 1,3-BENZODIOXOLE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CYP2C9, CYP1B1, SULT1A1 LPL 2984/4885LIPG 3537/4885EGFR 4451/4885
US-20210403485-A1 PYRAZOLOPYRIMIDINE DERIVATIVE AS SELECTIVE TRK INHIBITOR NTRK1, RET, TTK LPL 4396/4885LIPG 4638/4885EGFR 427/4885

“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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