SCHEMBL2941744

SCHEMBL2941744

C=Cc1cccc(C(=O)Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
UNG P13051 1/20 0.46
TP53 P04637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTGS2 P35354 1/20 0.41
TTR P02766 4/20 0.40
RHOA P61586 1/20 0.38
FBP1 P09467 1/20 0.38
AKT1 P31749 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
MAOB P27338 1/20 0.38
P4HB P07237 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL28242748 0.83 TDP1 (0.52) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL29055882 0.83 TTR (0.55) ALDH1A1TSHRUNGTTRFBP1
Benzene SCHEMBL16487418 0.82 UNG (0.68) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL21777904 0.82 UNG (0.68) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL1902705 0.82 UNG (0.68) ALDH1A1TSHRUNGPTGS2TTR
SCHEMBL29373775 0.82 UNG (0.68) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL15036 0.82 UNG (0.68) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL2164103 0.82 UNG (0.47) ALDH1A1TSHRUNGTP53TDP1
SCHEMBL12449045 0.82 TP53 (0.47) ALDH1A1TSHRUNGTP53TDP1
Benzoyl Chloride SCHEMBL8178226 0.81 CYP2C19 (0.36) ALDH1A1TSHRUNGTP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024135498-A1 RESIST COMPOSITION, RESIST PATTERN FORMATION METHOD, AND COMPOUND 東京応化工業株式会社 2024-06-27 WO disclosed
US-11820787-B2 Benfotiamine derivatives in the treatment of alzheimer's disease SHANGHAI RAISING PHARMACEUTICAL CO., LTD. (CN) 2023-11-21 US disclosed
US-11709427-B2 Positive resist composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-07-25 US disclosed
EP-4037687-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS Molecular Skin Therapeutics, Inc. (US) 2022-08-10 EP disclosed
US-20210247694-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-08-12 US disclosed
CN-112933101-A Benfotiamine derivative, preparation method and pharmaceutical composition thereof 上海日馨生物科技有限公司 2021-06-11 CN disclosed
CN-112898342-A Benfotiamine derivative, preparation method and pharmaceutical composition thereof 上海日馨生物科技有限公司 2021-06-04 CN disclosed
US-20210163515-A1 BENFOTIAMINE DERIVATIVES IN THE TREATMENT OF ALZHEIMER'S DISEASE SHANGHAI RAISING PHARMACEUTICAL CO., LTD. (CN) 2021-06-03 US disclosed
US-10947258-B1 Benfotiamine derivatives, method for preparing the same and pharmaceutical composition comprising the same SHANGHAI RIXIN BIOTECHNOLOGY CO., LTD. (CN) 2021-03-16 US disclosed
CN-109111478-B Benfotiamine derivative, preparation method and pharmaceutical composition thereof 上海日馨生物科技有限公司 2021-02-26 CN disclosed
US-20040220346-A1 Multi-branched polymer, process for producing the same, and applications thereof MITSUI CHEMICALS, INC. (JP) 2004-11-04 US disclosed
US-20040191602-A1 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2004-09-30 US disclosed
EP-1457511-A1 CROSSLINKABLE AROMATIC RESINS HAVING PROTONIC ACID GROUPS AND ION CONDUCTIVE POLYMER MEMBRANES BINDERS AND FUEL CELLS MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-09-15 EP disclosed
EP-1457512-A1 Multi-branched polymer, process for producing the same, and applications thereof Mitsui Chemicals, Inc. (JP) 2004-09-15 EP disclosed
EP-1396504-A2 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof Mitsui Chemicals, Inc. (JP) 2004-03-10 EP disclosed
EP-0768862-B1 PERSONAL CARE COMPOSITIONS CONTAINING THERMOPLASTIC ELASTOMERIC GRAFT COPOLYMERS PROCTER & GAMBLE (US) 2001-10-17 EP disclosed
US-6165455-A Personal care compositions containing thermoplastic elastomeric graft copolymers THE PROCTER & GAMBLE COMPANY (US) 2000-12-26 US disclosed
US-6041157-A Environmentally sensitive compositions of matter based on 3H-fluoren-3-ylidenes and process for making same GOETZ FREDERICK JAMES (US) 2000-03-21 US disclosed
EP-0768862-A1 PERSONAL CARE COMPOSITIONS CONTAINING THERMOPLASTIC ELASTOMERIC GRAFT COPOLYMERS THE PROCTER & GAMBLE COMPANY (US) 1997-04-23 EP disclosed
WO-1996000562-A1 PERSONAL CARE COMPOSITIONS CONTAINING THERMOPLASTIC ELASTOMERIC GRAFT COPOLYMERS THE PROCTER & GAMBLE COMPANY (US) 1996-01-11 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 (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-10947258-B1 Benfotiamine derivatives, method for preparing the same and pharmaceutical composition comprising the same COMT, BACE1, BACE2 ALDH1A1 3189/4885TSHR 1203/4885UNG 1838/4885
US-11709427-B2 Positive resist composition and pattern forming process EWSR1, PARG, VIM ALDH1A1 3639/4885TSHR 4671/4885UNG 3468/4885
US-11820787-B2 Benfotiamine derivatives in the treatment of alzheimer's disease PSEN2, PSEN1, SLC18A2 ALDH1A1 1876/4885TSHR 2327/4885UNG 1495/4885
US-20210163515-A1 BENFOTIAMINE DERIVATIVES IN THE TREATMENT OF ALZHEIMER'S DISEASE PSEN2, PSEN1, SLC18A2 ALDH1A1 1876/4885TSHR 2327/4885UNG 1495/4885
US-20210247694-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS EWSR1, PARG, VIM ALDH1A1 3639/4885TSHR 4671/4885UNG 3468/4885

“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.