SCHEMBL3043857

SCHEMBL3043857

NC(=O)C1CCCOC1[O]

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.43
NOS2 P35228 1/20 0.39
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
HPGD P15428 2/20 0.33
CYP2C9 P11712 1/20 0.33
GRM4 Q14833 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TP53 P04637 1/20 0.30
ALOX12 P18054 1/20 0.30

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
SCHEMBL6213733 0.78 EPHX1 (0.43) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL28694029 0.78 EPHX1 (0.43) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL29384470 0.71 EPHX1 (0.41) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL9800227 0.70 EPHX1 (0.67) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL1570434 0.70 EPHX1 (0.67) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL2343227 0.70 EPHX1 (0.59) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL17205447 0.70 EPHX1 (0.67) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL9800070 0.70 EPHX1 (0.67) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL7362431 0.70 EPHX1 (0.59) EPHX1NOS2PSEN1PSEN2APH1B
SCHEMBL13557474 0.70 EPHX1 (0.67) EPHX1NOS2PSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11819484-B2 Retinoid derivatives with antitumor activity BIOGEM S.C. A R.L. (IT) 2023-11-21 US disclosed
CN-110114338-B Retinoid derivatives having antitumor activity 比奥吉公司 2022-10-21 CN disclosed
US-11364216-B2 Retinoid derivatives with antitumor activity BIOGEM S.C. A R.L. (IT) 2022-06-21 US disclosed
US-20220168252-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY BIOGEM S C A R L (IT) 2022-06-02 US disclosed
US-20210052530-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY BIOGEM S C A R L (IT) 2021-02-25 US disclosed
US-10905668-B2 Retinoid derivatives with antitumor activity BIOGEM S.C. A R.L. (IT) 2021-02-02 US disclosed
EP-3519383-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY Biogem S.C. A R.L. (IT) 2019-08-07 EP disclosed
WO-2018060354-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY BIOGEM S.CA.R.L. (IT) 2018-04-05 WO disclosed
EP-3301085-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY BIOGEM S.CA.R.L. (IT) 2018-04-04 EP disclosed
US-20160376286-A1 Pyrimidin-4-one derivatives and their use in the tratement, amelioration or prevention of a viral disease F. HOFFMAN-LA ROCHE LTD 2016-12-29 US disclosed
US-20040167182-A1 Hydroxamic acid and amide compounds and their use as protease inhibitors PHARMACIA CORPORATION 2004-08-26 US disclosed
US-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors PHARMACIA CORPORATION 2004-07-22 US disclosed
WO-2004048368-A2 HETEROARYLSULFONYLMETHYL HYDROXAMIC ACIDS AND AMIDES AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2004-06-10 WO disclosed
WO-2004013130-A1 SUBSTITUTED THIENYL-HYDROXAMIC ACIDS AS HISTONE DEACETYLASE INHIBITORS ARGENTA DISCOVERY LIMITED (GB) 2004-02-12 WO disclosed
WO-2004000811-A1 ARYLSULFONYLHYDROXAMIC ACID AND AMIDE DERIVATIVES AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-12-31 WO disclosed
WO-2003091247-A2 PIPERIDINYL-AND PIPERAZINYL-SULFONYLMETHYL HYDROXAMIC ACIDS AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-11-06 WO disclosed
EP-1301517-A1 THIENOPYRROLIDINONES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-16 EP disclosed
US-6528653-B2 E.g., 4,6-dihydro 4-(heterocyclic ring-methylene)thieno(2,3-b) pyrrolidin-5-one derivatives; tumor necrosis factor ) inhibitors; anticarcinogenic, -proliferative and -arthritic agents; Alzheimer's disease; cardiovascular disorders HOFFMANN-LA ROCHE, INC. 2003-03-04 US disclosed
US-20020028841-A1 Thienopyrrolidinones F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 US disclosed
WO-2002002567-A1 THIENOPYRROLIDINONES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-10 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 (9 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-20220168252-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY RARA, RARB, RARG EPHX1 610/4885NOS2 1249/4885PSEN1 4007/4885
US-10905668-B2 Retinoid derivatives with antitumor activity RARA, RARB, RARG EPHX1 610/4885NOS2 1249/4885PSEN1 4007/4885
US-20040167182-A1 Hydroxamic acid and amide compounds and their use as protease inhibitors MMP1, MMP3, MMP13 EPHX1 354/4885NOS2 2407/4885PSEN1 960/4885
US-11819484-B2 Retinoid derivatives with antitumor activity RARA, RARB, RARG EPHX1 610/4885NOS2 1249/4885PSEN1 4007/4885
US-20210052530-A1 RETINOID DERIVATIVES WITH ANTITUMOR ACTIVITY RARA, RARB, RARG EPHX1 610/4885NOS2 1249/4885PSEN1 4007/4885
US-20160376286-A1 Pyrimidin-4-one derivatives and their use in the tratement, amelioration or prevention of a viral disease TTR, TYMP, TPMT EPHX1 1895/4885NOS2 3838/4885PSEN1 122/4885
US-20040142979-A1 Heteroarylsulfonylmethyl hydroxamic acids and amides and their use as protease inhibitors MMP3, MMP13, MMP10 EPHX1 899/4885NOS2 1533/4885PSEN1 1350/4885
US-11364216-B2 Retinoid derivatives with antitumor activity RARA, RARB, RARG EPHX1 610/4885NOS2 1249/4885PSEN1 4007/4885
US-20020028841-A1 Thienopyrrolidinones TNF, TYMP, TNFRSF1A EPHX1 1193/4885NOS2 519/4885PSEN1 446/4885

“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.