SCHEMBL7278568

SCHEMBL7278568

O=C(O)CC1CCC(=O)O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.46
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ITGB3 P05106 3/20 0.36
ITGA2B P08514 3/20 0.36
ITGB2 P05107 1/20 0.36
ITGB1 P05556 1/20 0.36
ITGAV P06756 1/20 0.36
ITGA5 P08648 1/20 0.36
ITGB5 P18084 1/20 0.36
ITGAL P20701 1/20 0.36
APEX1 P27695 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MIF P14174 1/20 0.33

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
SCHEMBL31710559 0.88 CYP1A2 (0.36) CYP1A2CA1CA9CYP2D6CYP2C9
SCHEMBL9067300 0.86 CYP1A2 (0.35) CYP1A2CA1CA9CYP2D6CYP2C9
SCHEMBL3629961 0.82 CYP1A2 (0.49) CYP1A2CA1CA9MIF
SCHEMBL10688261 0.82 CYP1A2 (0.44) CYP1A2CA1CA9ALDH1A1POLB
SCHEMBL19547206 0.81 CYP1A2 (0.41) CYP1A2CA1CA9
SCHEMBL1114400 0.80 CYP1A2 (0.51) CYP1A2CA1CA9
SCHEMBL19313428 0.78 CYP1A2 (0.36) CYP1A2CYP2D6CYP2C9CYP2C19ITGB3
SCHEMBL8584608 0.77 CYP1A2 (0.45) CYP1A2CA1CA9MIF
Oxalic Acid SCHEMBL28140423 0.76 CYP1A2 (0.51) CYP1A2CA1CA9CYP2D6CYP2C19
Methacrylic Acid SCHEMBL6282496 0.76 CYP1A2 (0.41) CYP1A2CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306515-B1 3-HYDROXYADIPIC ACID 3,6-LACTONE COMPOSITION TORAY INDUSTRIES (JP) 2026-02-04 EP claimed
US-20240140927-A1 3-HYDROXYADIPIC ACID 3,6-LACTONE COMPOSITION TORAY INDUSTRIES, INC. (JP) 2024-05-02 US claimed
EP-4306515-A1 3-HYDROXYADIPIC ACID 3,6-LACTONE COMPOSITION Toray Industries, Inc. (JP) 2024-01-17 EP claimed
US-11760739-B2 Method of producing 3-hydroxyadipic acid-3,6-lactone TORAY INDUSTRIES, INC. (JP) 2023-09-19 US claimed
CN-114806414-B Silicon polishing composition, preparation method and application thereof 万华化学集团电子材料有限公司 2023-07-11 CN claimed
CN-110023285-B Process for producing epsilon-caprolactam 东丽株式会社 2023-01-17 CN claimed
US-20220356140-A1 METHOD FOR PRODUCING ADIPIC ACID TORAY INDUSTRIES, INC. (JP) 2022-11-10 US claimed
WO-2022191314-A1 3-HYDROXYADIPIC ACID 3,6-LACTONE COMPOSITION 東レ株式会社 2022-09-15 WO claimed
CN-114806414-A Silicon polishing composition, preparation method and application thereof 万华化学集团电子材料有限公司 2022-07-29 CN claimed
EP-3553048-B1 METHOD FOR PRODUCING EPSILON-CAPROLACTAM TORAY INDUSTRIES (JP) 2022-07-27 EP claimed
EP-3950680-A1 METHOD FOR PRODUCING 3-HYDROXYADIPIC ACID-3,6-LACTONE Toray Industries, Inc. (JP) 2022-02-09 EP claimed
CN-113574052-A Method for producing 3-hydroxyadipic acid-3, 6-lactone 东丽株式会社 2021-10-29 CN claimed
US-11149001-B2 Method for producing ϵ-caprolactam TORAY INDUSTRIES, INC. (JP) 2021-10-19 US claimed
WO-2020196459-A1 METHOD FOR PRODUCING 3-HYDROXYADIPIC ACID-3,6-LACTONE 東レ株式会社 2020-10-01 WO claimed
CN-107074761-B Process for producing epsilon-caprolactam 东丽株式会社 2020-04-14 CN claimed
US-20200062704-A1 METHOD FOR PRODUCING epsilon-CAPROLACTAM TORAY INDUSTRIES, INC. (JP) 2020-02-27 US claimed
EP-3553048-A1 METHOD FOR PRODUCING -CAPROLACTAM Toray Industries, Inc. (JP) 2019-10-16 EP claimed
US-10196352-B2 Method for producing epsilon-caprolactam TORAY INDUSTRIES, INC. (JP) 2019-02-05 US claimed
US-20170320819-A1 METHOD FOR PRODUCING EPSILON-CAPROLACTAM TORAY INDUSTRIES, INC. (JP) 2017-11-09 US claimed
EP-3214072-A1 METHOD FOR PRODUCING -CAPROLACTAM Toray Industries, Inc. (JP) 2017-09-06 EP 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 (6 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-20170320819-A1 METHOD FOR PRODUCING EPSILON-CAPROLACTAM HACL2, HM13, ALAD CYP1A2 3054/4885CA1 679/4885CA9 431/4885
US-20200062704-A1 METHOD FOR PRODUCING epsilon-CAPROLACTAM HAMP, NAAA, CAPN9 CYP1A2 1573/4885CA1 1813/4885CA9 548/4885
US-20220356140-A1 METHOD FOR PRODUCING ADIPIC ACID ADIPOR1, ACSL3, ADH7 CYP1A2 2094/4885CA1 752/4885CA9 512/4885
US-11149001-B2 Method for producing ϵ-caprolactam NAAA, HAMP, CAPN9 CYP1A2 1297/4885CA1 1676/4885CA9 455/4885
US-20240140927-A1 3-HYDROXYADIPIC ACID 3,6-LACTONE COMPOSITION DHCR7, HSD3B1, HMGCR CYP1A2 2039/4885CA1 886/4885CA9 374/4885
US-10196352-B2 Method for producing epsilon-caprolactam HACL2, HM13, ALAD CYP1A2 3054/4885CA1 679/4885CA9 431/4885

“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.