SCHEMBL516874

SCHEMBL516874

Cc1ccc(C(=O)OC(=O)C(O)C(O)C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 3/20 0.41
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
LMNA P02545 1/20 0.41
SRD5A2 P31213 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL923829 1.00 TDP1 (0.48) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL29733565 1.00 TDP1 (0.48) TDP1RAB9ANPC1ADRB2ADRB1
Water SCHEMBL4813848 0.98 TDP1 (0.47) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL29673261 0.93 TDP1 (0.55) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL1489599 0.93 TDP1 (0.55) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL424471 0.93 TDP1 (0.55) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL697038 0.93 TDP1 (0.55) TDP1RAB9ANPC1ADRB2ADRB1
Water SCHEMBL9529895 0.91 TDP1 (0.53) TDP1RAB9ANPC1ADRB2ADRB1
Water SCHEMBL8461991 0.91 TDP1 (0.53) TDP1RAB9ANPC1ADRB2ADRB1
SCHEMBL28794540 0.84 ALOX15 (0.45) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114763339-A Process for the preparation of triazine derivatives 江苏恒瑞医药股份有限公司 2022-07-19 CN claimed
EP-4739669-A1 SODIUM CHANNEL BLOCKERS Novartis AG (CH) 2026-05-13 EP disclosed
CN-122010912-A Antiviral 1, 3-dioxoindene compounds 诺华股份有限公司 2026-05-12 CN disclosed
CN-122010905-A Pyrazolyl derivatives as anticancer agents 诺华股份有限公司 2026-05-12 CN disclosed
EP-4665734-A1 CYCLIN-DEPENDENT KINASE (CDK2) INHIBITORS Novartis AG (CH) 2025-12-24 EP disclosed
EP-4626890-A1 RIBOCICLIB SALTS AND FORMULATIONS THEREOF KRKA, d.d., Novo mesto (SI) 2025-10-08 EP disclosed
EP-4436662-B1 NAPHTHYRIDINONE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER NOVARTIS AG (CH) 2025-09-17 EP disclosed
US-20250223297-A1 NOVEL RAPAMYCIN DERIVATIVES NOVARTIS AG (CH) 2025-07-10 US disclosed
EP-4577550-A1 NOVEL NLRP3 INFLAMMASOME INHIBITORS Hangzhou Highlightll Pharmaceutical Co., Ltd. (CN) 2025-07-02 EP disclosed
US-20250197376-A1 PYRAZINE AMIDE DERIVATIVES NOVARTIS AG (CH) 2025-06-19 US disclosed
WO-2009091561-A1 PREPARATION AND ENANTIOMERIC SEPARATION OF 7-(3-PYRIDINYL)-1,7-DIAZASPIRO[4.4] NONANE AND NOVEL SALT FORMS OF THE RACEMATE AND ENANTIOMERS TARGACEPT, INC. (US) 2009-07-23 WO disclosed
CN-101273048-A Sulfonamide derivatives as glycokinase activators useful in the treatment of type 2 diabetes NOVARTIS AG (CH) 2008-09-24 CN disclosed
EP-1911754-A1 Dipeptidyl peptidase inhibitors Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
CN-1886374-A Process for preparing (3-oxo-2,3-dihydro-1h-isoindol-1-yl) acetylguanidine derivatives AVENTIS PHARMA GMBH (DE) 2006-12-27 CN disclosed
CN-1146992-A Process for preparation of intermediate (R)-3-amino-5-methoxychroman ASTRA AB (SE) 1997-04-09 CN disclosed
CN-1072411-A Novel active compounds for use in therapy ASTRA AB (SE) 1993-05-26 CN disclosed
EP-0160502-B1 Improvements in and relating to octahydrothiazolo[4,5-g]quinolines ELI LILLY AND COMPANY (US) 1991-09-25 EP disclosed
EP-0172697-B1 Octahydro-oxazolo[4,5-g]quinolines ELI LILLY AND COMPANY (US) 1991-09-25 EP disclosed
EP-0139393-B1 PYRIMIDO(4,5-G)QUINOLINES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ELI LILLY AND COMPANY (US) 1991-05-15 EP disclosed
EP-0347229-A1 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-12-20 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 (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-20250197376-A1 PYRAZINE AMIDE DERIVATIVES SIRT5, GLS2, ARG2 TDP1 4417/4885RAB9A 1611/4885NPC1 1853/4885
US-20250223297-A1 NOVEL RAPAMYCIN DERIVATIVES MTOR, RICTOR, RPTOR TDP1 2721/4885RAB9A 160/4885NPC1 156/4885

“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.