SCHEMBL44567

SCHEMBL44567

C=C1C2[C@H](OC(C)=O)C3CC(=O)C(C)=C([C@@H](OC(C)=O)C(OC(C)=O)C2(C)CC[C@@H]1OC(=O)/C=C\c1ccccc1)C3(C)C

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.43
ABCB1 P08183 16/20 0.37
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
CYP2C19 P33261 1/20 0.35

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
SCHEMBL31384147 1.00 NLRP3 (0.43) NLRP3ABCB1OPRM1OPRD1OPRK1
Taxine Ii SCHEMBL30563046 0.80
Taxinine A SCHEMBL30495377 0.80 RAB9A (0.32) ABCB1
SCHEMBL44737 0.72 NLRP3 (0.47) NLRP3ABCB1OPRM1OPRD1OPRK1
Taxuspine F SCHEMBL30602496 0.68 RAB9A (0.31)
SCHEMBL29394113 0.68 ABCB1 (0.31) ABCB1CYP2C19
SCHEMBL44183 0.67 ABCB1 (0.41) NLRP3ABCB1
SCHEMBL29425006 0.66 NLRP3 (0.38) NLRP3ABCB1CYP2C19
Taxagifine SCHEMBL29520283 0.66 ABCB1 (0.40) NLRP3ABCB1CYP2C19
Taxagifine SCHEMBL28964410 0.66 ABCB1 (0.40) NLRP3ABCB1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250000924-A1 Composition for the prevention, improvement or treatment of allergic disease comprising an extract of Taxus cuspidata as an active ingredient KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2025-01-02 US claimed
CN-104606677-B A kind of taxanes composition for improving paclitaxel oral bioavilability and its application 中山大学 2018-04-03 CN claimed
EP-2832371-B1 APPLICATION OF GASTRODIN AS SOLUBILIZER AND METHOD FOR PREPARING INJECTION OR POWDER FOR INJECTION KPC PHARMACEUTICALS INC (CN) 2017-02-01 EP claimed
CN-106265598-A A kind of based on biological functionalized nano silver paclitaxel loaded or the targeted delivery systems of its analog 广东工业大学 2017-01-04 CN claimed
CN-104606677-A Taxol oral bioavailability improving taxane composition and application UNIV SUN YAT SEN 2015-05-13 CN claimed
EP-2832371-A1 APPLICATION OF GASTRODIN AS SOLUBILIZER AND METHOD FOR PREPARING INJECTION OR POWDER FOR INJECTION Kunming Pharmaceutical Corp. (CN) 2015-02-04 EP claimed
US-8710013-B2 Pharmaceutical compositions of paclitaxel, paclitaxel analogs or paclitaxel conjugates and related methods of preparation and use ANGIOCHEM INC. (CA) 2014-04-29 US claimed
US-7846666-B2 Methods of RNA amplification in the presence of DNA NUGEN TECHNOLOGIES, INC. (US) 2010-12-07 US claimed
WO-2009117698-A2 METHODS OF RNA AMPLIFICATION IN THE PRESENCE OF DNA NUGEN TECHNOLOGIES, INC. (US) 2009-09-24 WO claimed
US-20090239232-A1 METHODS OF RNA AMPLIFICATION IN THE PRESENCE OF DNA NUGEN TECHNOLOGIES INC (US) 2009-09-24 US claimed
US-20080075794-A1 Mixture of natural plant extracts comprising extracts from Taxus and Thymus; capable of strong antimicrobial ability as well as the elimination of foul odors BAE CHANGSOON 2008-03-27 US claimed
CN-1256308-C Yew genus plant extract and its extraction method and application HEILONGJIANG YEW TECHNOLOGY CO (CN) 2006-05-17 CN claimed
CN-1594247-A Yew genus plant extract and its extraction method and application HEILONGJIANG YEW SCIENCE AND T (CN) 2005-03-16 CN claimed
CN-1397233-A Natural Japanese yew beverage LI MEISHENG (CN) 2003-02-19 CN claimed
CN-1307890-A Tuberculosis-resisting toxol medicine LI MEISHENG (CN) 2001-08-15 CN claimed
CN-1301562-A Anticancer Chinese medicine yew liquid LI MEISHENG (CN) 2001-07-04 CN claimed
CN-1301542-A Taxad medicine wine LI MEISHENG (CN) 2001-07-04 CN claimed
CN-122070906-A Pharmaceutical composition of paclitaxel conjugate and preparation method thereof 北京盛诺基医药科技股份有限公司 2026-05-22 CN disclosed
US-5481010-A FOR USE IN THERAPY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1996-01-02 US disclosed
WO-1993002064-A1 NOVEL 7-DEACETOXY BACCATINE IV DERIVATIVE, AND PREPARATION AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1993-02-04 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 (1 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-20250000924-A1 Composition for the prevention, improvement or treatment of allergic disease comprising an extract of Taxus cuspidata as an active ingredient SERPINB1, TSLP, CMA1 NLRP3 1715/4885ABCB1 123/4885OPRM1 3684/4885

“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.