SCHEMBL2850663

SCHEMBL2850663

CCC(C)(CCC(C)C)C(=O)OCC1CO1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
MGLL Q99685 3/20 0.31

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
SCHEMBL25797198 0.85 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL9925442 0.85 ALDH1A1 (0.49) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL9952240 0.82 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL2203833 0.82 TSHR (0.39) ALDH1A1TSHRMAPK1
SCHEMBL10773349 0.81 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL18879808 0.79 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL15868639 0.79 ALDH1A1 (0.36) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL12900126 0.79 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL23907058 0.78 MMP8 (0.45) ALDH1A1CYP3A4TSHR
SCHEMBL30396753 0.78 MMP8 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503435-B2 Aziridine functional compound COVESTRO (NETHERLANDS) B.V. (NL) 2025-12-23 US claimed
US-20230140764-A1 AZIRIDINE FUNCTIONAL COMPOUND COVESTRO (NETHERLANDS) B.V. (NL) 2023-05-04 US claimed
EP-4093799-A1 AZIRIDINE FUNCTIONAL COMPOUND Covestro (Netherlands) B.V. (NL) 2022-11-30 EP claimed
CN-115003722-A Aziridine functional compounds 科思创(荷兰)有限公司 2022-09-02 CN claimed
WO-2021148561-A1 AZIRIDINE FUNCTIONAL COMPOUND COVESTRO (NETHERLANDS) B.V. (NL) 2021-07-29 WO claimed
US-12637423-B2 Aziridinyl functional compound COVESTRO (NETHERLANDS) B.V. (NL) 2026-05-26 US disclosed
US-12565473-B2 Coating composition COVESTRO (NETHERLANDS) B.V. (NL) 2026-03-03 US disclosed
WO-2026041607-A1 AZIRIDINYL-FUNCTIONAL ORGANIC COMPOUNDS COVESTRO (NETHERLANDS) B.V. (NL) 2026-02-26 WO disclosed
US-12503435-B2 Aziridine functional compound COVESTRO (NETHERLANDS) B.V. (NL) 2025-12-23 US disclosed
US-12398098-B2 Waterborne crosslinker composition COVESTRO (NETHERLANDS) B.V. (NL) 2025-08-26 US disclosed
US-12378189-B2 Multi-aziridine compound COVESTRO (NETHERLANDS) B.V. (NL) 2025-08-05 US disclosed
US-12378188-B2 Waterborne crosslinker composition COVESTRO (NETHERLANDS) B.V. (NL) 2025-08-05 US disclosed
WO-2013072481-A1 GLYCEROL DIESTERS, METHOD FOR PRODUCING SAME, AND USE OF SAME IN COATING AGENTS BASF COATINGS GMBH (DE) 2013-05-23 WO disclosed
US-20120157620-A1 AMINE-EPOXY ADDUCTS AND THEIR USE FOR PREPARING POLYUREA AND POLYUREA-POLYURETHANE COATINGS POLINVENT KFT. (HU) 2012-06-21 US disclosed
US-20100126664-A1 Polyester Polyols for Polyurethane Adhesives STEPAN COMPANY 2010-05-27 US disclosed
US-20060205909-A1 Polyester polyols for polyurethane adhesives O'BRIEN MICHAEL E 2006-09-14 US disclosed
US-20050171301-A1 Reworkable thermosetting resin compositions LOCTITE CORPORATION 2005-08-04 US disclosed
WO-2004083274-A1 POLYESTER POLYOLS FOR POLYURETHANE ADHESIVES STEPAN COMPANY (US) 2004-09-30 WO disclosed
US-6656530-B2 Automotive refinish coatings with low volatile organic content BASF CORPORATION 2003-12-02 US disclosed
US-20030149192-A1 Automotive refinish coatings with low volatile organic content BASF CORPORATION 2003-08-07 US 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 (8 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-12565473-B2 Coating composition MSR1, MCHR1, SIGMAR1 ALDH1A1 2723/4885TP53 3794/4885CYP3A4 1066/4885
US-12398098-B2 Waterborne crosslinker composition AAAS, WDR48, WDR1 ALDH1A1 202/4885TP53 1388/4885CYP3A4 1032/4885
US-12378188-B2 Waterborne crosslinker composition HRH1, HRH2, CHRM1 ALDH1A1 1522/4885TP53 2911/4885CYP3A4 1255/4885
US-20120157620-A1 AMINE-EPOXY ADDUCTS AND THEIR USE FOR PREPARING POLYUREA AND POLYUREA-POLYURETHANE COATINGS PCNA, PNMT, CHKB ALDH1A1 837/4885TP53 2772/4885CYP3A4 1812/4885
US-12637423-B2 Aziridinyl functional compound FPR1, UTS2R, UQCRB ALDH1A1 1232/4885TP53 4200/4885CYP3A4 995/4885
US-12503435-B2 Aziridine functional compound AZI2, PCNA, OGG1 ALDH1A1 1077/4885TP53 25/4885CYP3A4 1114/4885
US-20230140764-A1 AZIRIDINE FUNCTIONAL COMPOUND AZI2, PCNA, OGG1 ALDH1A1 1077/4885TP53 25/4885CYP3A4 1114/4885
US-12378189-B2 Multi-aziridine compound QDPR, PRMT9, JMJD6 ALDH1A1 494/4885TP53 2775/4885CYP3A4 3179/4885

“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.