SCHEMBL617480

SCHEMBL617480

O=C(O)c1c(O)cccc1F

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.70
CA1 P00915 3/20 0.70
CA2 P00918 3/20 0.70
CA7 P43166 3/20 0.70
CA9 Q16790 3/20 0.70
CA14 Q9ULX7 3/20 0.70
CES2 O00748 2/20 0.56
CES1 P23141 2/20 0.56
ALB P02768 1/20 0.52
THRB P10828 1/20 0.48
SPR P35270 1/20 0.44
TTR P02766 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
BID P55957 4/20 0.43
MCL1 Q07820 4/20 0.43
BCL2L1 Q07817 3/20 0.43
BAK1 Q16611 3/20 0.43
KAT8 Q9H7Z6 2/20 0.43
PPARG P37231 1/20 0.43

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
SCHEMBL28871108 0.98 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL260553 0.85 CES2 (0.67) CA12CA1CA2CA7CA9
SCHEMBL28566012 0.84 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL3117223 0.83 CES2 (0.64) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL7968059 0.83 CES2 (0.64) CA12CA1CA2CA7CA9
SCHEMBL5603402 0.83 CA1 (1.00) CA12CA1CA2CA7CA9
SCHEMBL224031 0.83 CA1 (1.00) CA12CA1CA2CA7CA9
SCHEMBL8130379 0.82 TTR (0.55) CA12CA1CA2CA7CA9
SCHEMBL31263802 0.82 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL8921906 0.80 CA1 (0.94) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092029-A1 LIGAND-ENABLED SCALABLE C-H HYDROXYLATION OF BENZOIC AND PHENYLACETIC ACIDS AT ROOM TEMPERATURE SCRIPPS RESEARCH INST (US) 2026-04-02 US claimed
EP-4584236-A1 LIGAND-ENABLED SCALABLE C-H HYDROXYLATION OF BENZOIC AND PHENYLACETIC ACIDS AT ROOM TEMPERATURE The Scripps Research Institute (US) 2025-07-16 EP claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117796401-A Preparation process of 2-hydroxy-6-fluorobenzoic acid methyl ester-containing intermediate antibacterial agent 江苏万隆化学有限公司 2024-04-02 CN claimed
WO-2024054881-A1 LIGAND-ENABLED SCALABLE C-H HYDROXYLATION OF BENZOIC AND PHENYLACETIC ACIDS AT ROOM TEMPERATURE THE SCRIPPS RESEARCH INSTITUTE (US) 2024-03-14 WO claimed
CN-113736232-B Modified biodegradable material and preparation method thereof 万华化学(宁波)有限公司 2023-07-14 CN claimed
US-11400102-B2 Treatment for bacterial infections with salicylic acid analogs WASHINGTON UNIVERSITY (US) 2022-08-02 US claimed
CN-113816940-A Nicotine salts, co-crystals and salt co-crystal complexes R.J.雷诺兹烟草公司 2021-12-21 CN claimed
CN-113754634-A Nicotine salts, co-crystals and salt co-crystal complexes R.J.雷诺兹烟草公司 2021-12-07 CN claimed
CN-113736232-A Modified biodegradable material and preparation method thereof 万华化学(宁波)有限公司 2021-12-03 CN claimed
US-20200368256-A1 Treatment for Bacterial Infections WASHINGTON UNIVERSITY (US) 2020-11-26 US claimed
CN-106336352-A Synthesis method of 6-fluorosalicylic acid 扬州天辰精细化工有限公司 2017-01-18 CN claimed
CN-102320960-A Preparation method of 6-fluoro salicylic acid ANHUI DONGJIAN CHEMICAL INDUSTRY CO LTD 2012-01-18 CN claimed
WO-2005021581-A2 INDUCERS OF PLANT DISEASE RESISTANCE VALENT BIOSCIENCES CORPORATION (US) 2005-03-10 WO claimed
US-20050050587-A1 Inducers of plant disease resistance VALENT BIOSCIENCES CORPORATION 2005-03-03 US claimed
US-20260107971-A1 AEROSOL GENERATING MATERIAL IN DISCRETE PORTIONS COMPRISING A SUBSTITUTED 3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE COMPOUND RAI STRATEGIC HOLDINGS INC (US) 2026-04-23 US disclosed
US-20260107968-A1 END PLUG COMPRISING A SUBSTITUTED 3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE RAI STRATEGIC HOLDINGS INC (US) 2026-04-23 US disclosed
US-5300640-A Herbicide intermediates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-04-05 US disclosed
US-5125957-A Pre- and postemergence herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-30 US disclosed
EP-0426476-A1 Pyrimidine derivatives, their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-08 EP 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-20260107971-A1 AEROSOL GENERATING MATERIAL IN DISCRETE PORTIONS COMPRISING A SUBSTITUTED 3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE COMPOUND H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CHRM3, CHRM1 CA12 2583/4885CA1 2910/4885CA2 1318/4885
US-20260092029-A1 LIGAND-ENABLED SCALABLE C-H HYDROXYLATION OF BENZOIC AND PHENYLACETIC ACIDS AT ROOM TEMPERATURE CYP2B6, CYP2A6, CYP1A1 CA12 1761/4885CA1 430/4885CA2 179/4885
US-20200368256-A1 Treatment for Bacterial Infections BPGM, BLVRB, LRBA CA12 3111/4885CA1 3512/4885CA2 2998/4885
US-20260107968-A1 END PLUG COMPRISING A SUBSTITUTED 3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE ALK, EXOSC4, EXOSC9 CA12 4013/4885CA1 4122/4885CA2 3788/4885
US-11400102-B2 Treatment for bacterial infections with salicylic acid analogs BPGM, LRBA, LTC4S CA12 3217/4885CA1 3643/4885CA2 3213/4885

“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.