SCHEMBL9113

SCHEMBL9113

O=C(O)Cc1cccc(F)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.58
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
SLC1A1 P43005 2/20 0.51
NR4A2 P43354 2/20 0.50
HCAR2 Q8TDS4 1/20 0.50
FFAR1 O14842 1/20 0.50
SRC P12931 1/20 0.50
CNR2 P34972 1/20 0.49
TAAR1 Q96RJ0 1/20 0.48
KDM4E B2RXH2 1/20 0.48
RGS12 O14924 1/20 0.48
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
APEX1 P27695 1/20 0.48

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
Hydrochloric Acid SCHEMBL2531929 0.98 AKR1B1 (0.56) AKR1B1CYP1A2CYP2C19SLC1A1NR4A2
SCHEMBL20616356 0.96 AKR1B1 (0.64) AKR1B1CYP1A2CYP2C19SLC1A1FFAR1
SCHEMBL13802492 0.89 GRIN2D (0.55) AKR1B1CYP1A2CYP2C19NR4A2FFAR1
SCHEMBL6864466 0.85 TAAR1 (0.50) SLC1A1NR4A2HCAR2SRCTAAR1
SCHEMBL27814786 0.85 FFAR1 (0.49) SLC1A1NR4A2HCAR2FFAR1SRC
SCHEMBL70565 0.84 AKR1B1 (0.71) AKR1B1CYP1A2CYP2C19KDM4ERGS12
SCHEMBL5791660 0.84 SLC1A1 (0.49) CYP1A2CYP2C19SLC1A1NR4A2HCAR2
SCHEMBL11178482 0.84 SRC (0.55) AKR1B1SLC1A1NR4A2HCAR2SRC
Syringol SCHEMBL28068479 0.83 GAA (0.54) GAATSHRNFKB1TDP1
Hydrochloric Acid SCHEMBL8922940 0.82 AKR1B1 (0.68) AKR1B1CYP1A2CYP2C19KDM4ERGS12

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 1687 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4127157-B1 MODIFIED DIPEPTIDE CLEAVASES, USES THEREOF AND RELATED KITS ENCODIA INC (US) 2026-02-11 EP claimed
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
WO-2025057535-A1 SEPARATION MEMBRANE 日東電工株式会社 2025-03-20 WO claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO claimed
CN-115073485-B 3-aryl-7, 8-pyranocoumarin derivative, and preparation method and application thereof 广西中医药大学 2024-02-23 CN claimed
US-20240011009-A1 MODIFIED DIPEPTIDE CLEAVASES, USES THEREOF AND RELATED KITS Encodia, Inc. (US) 2024-01-11 US claimed
CN-117363132-A Thermochromic curtain wall finish paint and processing technology thereof 洛阳宇信新材料科技有限公司 2024-01-09 CN claimed
CN-117143097-A Beta-carbopol compound, preparation method thereof and application of beta-carbopol compound in resisting Alzheimer disease 中国人民解放军北部战区总医院 2023-12-01 CN claimed
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN claimed
US-20230220589-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2023-07-13 US claimed
US-7732625-B2 Colorant compounds XEROX CORPORATION (US) 2010-06-08 US claimed
CN-101186586-A N,N'-difluorophenyl derivative of 4-methoxyl-1,3-phthalamide and use thereof UNIV TIANJIN TECHNOLOGY (CN) 2008-05-28 CN claimed
US-7311767-B2 Forming a salt of a liquid phase change ink carrier of stearyl stearamide, an amine substituted Xanthene, acridine, anthracene or thioxanthene chromogen, and a metal salt capable of forming a compound with two chromogens XEROX CORPORATION (US) 2007-12-25 US claimed
US-7033424-B2 Phase change inks XEROX CORPORATION (US) 2006-04-25 US claimed
US-20060021546-A1 Processes for preparing phase change inks XEROX CORPORATION 2006-02-02 US claimed
US-20060020141-A1 Metallized dye XEROX CORPORATION 2006-01-26 US claimed
US-20060016369-A1 PHASE CHANGE INKS XEROX CORPORATION 2006-01-26 US claimed
US-6946025-B2 Process for preparing tetra-amide compounds XEROX CORPORATION (US) 2005-09-20 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed

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-20060020141-A1 Metallized dye CDYL, CDY1; CDY1B, CDYL2 AKR1B1 1963/4885CYP1A2 1066/4885CYP2C19 1490/4885
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 AKR1B1 2784/4885CYP1A2 968/4885CYP2C19 1364/4885

“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.