SCHEMBL1126729

SCHEMBL1126729

CCOC(=O)C(=NO)C(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
MAPT P10636 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CES2 O00748 4/20 0.46
CES1 P23141 4/20 0.46
NPC1 O15118 1/20 0.45
CYP19A1 P11511 2/20 0.43
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL1968821 1.00 ALDH1A1 (0.61) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL19663921 1.00 ALDH1A1 (0.61) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL16613214 0.88 NPC1 (0.49) ALDH1A1MAPTSMN1; SMN2NPC1LMNA
SCHEMBL18017521 0.87 CES2 (0.48) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL7991675 0.87 CES2 (0.48) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL7991679 0.87 CES2 (0.48) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL7935150 0.85 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL4372774 0.84 HTT (0.55) ALDH1A1MAPTMEN1KMT2ACES2
SCHEMBL7978018 0.84 MAPT (0.49) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL7991893 0.84 MAPT (0.53) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114105881-B Platelet aggregation inhibitor, and preparation method and application thereof 沈阳海诺威医药科技有限公司 2024-01-26 CN disclosed
US-11819503-B2 Method of treating coccidioides infection F2G LTD (GB) 2023-11-21 US disclosed
CN-109982704-B Pharmaceutical preparation F2G有限公司 2023-10-24 CN disclosed
EP-3960734-B1 PLATELET AGGREGATION INHIBITOR, PREPARATION AND USES THEREOF SHENYANG HINEWY PHARMACEUTICAL TECH CO LTD (CN) 2023-10-11 EP disclosed
CN-116675704-A Pyrrole derivative and preparation method and application thereof 深圳市祥根生物医药有限公司 2023-09-01 CN disclosed
US-11713300-B2 Platelet aggregation inhibitor, preparation and uses thereof SHENYANG HINEWY PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2023-08-01 US disclosed
CN-114644634-B Pyrrole derivative and preparation method and application thereof 深圳市祥根生物医药有限公司 2023-06-20 CN disclosed
CN-111096967-B Antifungal agent F2G有限公司 2023-03-10 CN disclosed
WO-2022134837-A1 PYRROLE DERIVATIVE, AND PREPARATION METHOD AND USE THEREFOR 深圳市祥根生物医药有限公司 2022-06-30 WO disclosed
CN-114105881-A Platelet aggregation inhibitor and preparation method and application thereof 沈阳海诺威医药科技有限公司 2022-03-01 CN disclosed
EP-0587533-B1 Process for the preparation of alpha-aminoketone salts CIBA GEIGY AG (CH) 1997-03-12 EP disclosed
EP-0574028-B1 Dipeptide analogs of aspertame and process to prepare them as well as a new preparation of aspertame HAMPSHIRE CHEMICAL CORP (US) 1996-08-28 EP disclosed
US-5322964-A Process for the preparation of alpha-aminoketone salts CIBA-GEIGY CORPORATION (US) 1994-06-21 US disclosed
EP-0220923-B1 Dipeptides and process GRACE W R & CO (US) 1994-04-27 EP disclosed
EP-0587533-A2 Process for the preparation of alpha-aminoketone salts CIBA-GEIGY AG (CH) 1994-03-16 EP disclosed
EP-0574028-A1 Dipeptide analogs of aspertame and process to prepare them as well as a new preparation of aspertame HAMPSHIRE CHEMICAL CORP. (US) 1993-12-15 EP disclosed
US-4873359-A Process for preparing as partyl-phenylalanine dipeptides W. R. GRACE & CO. - CONN. (US) 1989-10-10 US disclosed
US-4810817-A ARTIFICIAL SWEETENERS W. R. GRACE & CO. (US) 1989-03-07 US disclosed
US-4710583-A ENZYMATIC COUPLING OF PHENYLSERINE WITH ASPARTIC ACID; HYDROGENATION W. R. GRACE & CO. (US) 1987-12-01 US disclosed
EP-0220923-A2 Dipeptides and process W.R. Grace & Co.-Conn. (US) 1987-05-06 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-11713300-B2 Platelet aggregation inhibitor, preparation and uses thereof TFPI, F12, TFPI2 ALDH1A1 1546/4885MAPT 36/4885SMN1; SMN2 2498/4885
US-11819503-B2 Method of treating coccidioides infection DPM1, OAT, OTC ALDH1A1 415/4885MAPT 3727/4885SMN1; SMN2 4231/4885

“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.