SCHEMBL2168639

SCHEMBL2168639

CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]2(C(=O)O)C[C@@H]1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F3 P13726 3/20 0.80
▸ SIRT5 Q9NXA8 3/20 0.80
▸ CYP3A4 P08684 1/20 0.80
▸ MAPK1 P28482 1/20 0.80
▸ OXTR P30559 1/20 0.80
▸ AVPR1A P37288 1/20 0.80
▸ CD81 P60033 1/20 0.80
▸ PTPN1 P18031 4/20 0.65
▸ RELA Q04206 4/20 0.65
▸ POLB P06746 3/20 0.65
▸ PTPN2 P17706 3/20 0.65
▸ CES1 P23141 3/20 0.65
▸ PSMB11 A5LHX3 2/20 0.65
▸ PSMA7 O14818 2/20 0.65
▸ AKR1B10 O60218 2/20 0.65
▸ PLA2G1B P04054 2/20 0.65
▸ PTPRC P08575 2/20 0.65
▸ PTPRF P10586 2/20 0.65
▸ PSMB1 P20618 2/20 0.65
▸ ACP1 P24666 2/20 0.65

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
SCHEMBL5797167 0.90 F3 (0.66) F3SIRT5CYP3A4MAPK1OXTR
SCHEMBL5797162 0.90 F3 (0.66) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL18712289 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL18704435 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL17030511 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL4454760 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL741321 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL42864 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL21892162 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR
Echinocystic Acid SCHEMBL13629642 0.89 F3 (1.00) F3SIRT5CYP3A4MAPK1OXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250089726-A1 BOTANICAL BASED BIO-STIMULANT, BIO-ACARICIDAL COMPOSITIONS KAY BEE BIO ORGANICS PVT LTD (IN) 2025-03-20 — — US claimed
US-20240415129-A1 BOTANICAL BASED BIO-INSECTICIDAL COMPOSITIONS FOR CONTROLLING PESTS AND IMPROVING THE PLANT PHYSIOLOGICAL PROCESS KAY BEE BIO ORGANICS PVT LTD (IN) 2024-12-19 — — US claimed
CN-107722146-A Method for producing solid polyaluminoxane composition 三井化学株式会社 2018-02-23 — — CN claimed
EP-1079824-B1 TRITERPENE COMPOSITIONS AND METHODS FOR USE THEREOF RES DEV FOUNDATION (US) 2011-08-31 — — EP claimed
US-7780974-B2 Avicin coated stents RESEARCH DEVELOPMENT FOUNDATION (US) 2010-08-24 — — US claimed
US-7670632-B2 Triterpene compositions and methods for use thereof RESEARCH DEVELOPMENT FOUNDATION (US) 2010-03-02 — — US claimed
EP-1079824-A4 TRITERPENE COMPOSITIONS AND METHODS FOR USE THEREOF RES DEV FOUNDATION (US) 2008-03-12 — — EP claimed
EP-1355642-A4 INHIBITION OF NF-(k)B BY TRITERPENE COMPOSITIONS RES DEV FOUNDATION (US) 2007-04-04 — — EP claimed
US-20060148732-A1 Inhibition of NF-kappaB by triterpene compositions RESEARCH DEVELOPMENT FOUNDATION 2006-07-06 — — US claimed
US-20060099236-A1 Coated stents RESEARCH DEVELOPMENT FOUNDATION (US) 2006-05-11 — — US claimed
US-20030203049-A1 Triterpene compositions and methods for use thereof RESEARCH DEVELOPMENT FOUNDATION 2003-10-30 — — US claimed
EP-1355642-A2 INHIBITION OF NF-(k)B BY TRITERPENE COMPOSITIONS RESEARCH DEVELOPMENT FOUNDATION (US) 2003-10-29 — — EP claimed
US-20030054052-A1 Triterpene compositions and methods for use thereof RESEARCH DEVELOPMENT FOUNDATION 2003-03-20 — — US claimed
US-20030039705-A1 Triterpene compositions and methods for use thereof RESEARCH DEVELOPMENT FOUNDATION 2003-02-27 — — US claimed
US-20030031738-A1 Triterpene compositions and methods for use thereof RESEARCH DEVELOPMENT FOUNDATION (US) 2003-02-13 — — US claimed
US-6444233-B1 ANTITUMOR AGENTS RESEARCH DEVELOPMENT FOUNDATION 2002-09-03 — — US claimed
WO-2002055016-A2 INHIBITION OF NF-λB BY TRITERPENE COMPOSITIONS RES DEV FOUNDATION (US) 2002-07-18 — — WO claimed
CN-1307473-A Triterpene compositions and methods of their use RES DEV FOUDATION (US) 2001-08-08 — — CN claimed
EP-1079824-A1 TRITERPENE COMPOSITIONS AND METHODS FOR USE THEREOF RESEARCH DEVELOPMENT FOUNDATION (a Nevada corporation) (US) 2001-03-07 — — EP claimed
WO-1999059578-A1 TRITERPENE COMPOSITIONS AND METHODS FOR USE THEREOF RESEARCH DEVELOPMENT FOUNDATION (US) 1999-11-25 — — WO 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-20030203049-A1 Triterpene compositions and methods for use thereof OSTC, ACACA, NFATC1 F3 1480/4885SIRT5 976/4885CYP3A4 2588/4885
US-20060099236-A1 Coated stents CD68, TEK, AREG F3 239/4885SIRT5 214/4885CYP3A4 3287/4885
US-20030031738-A1 Triterpene compositions and methods for use thereof OSTC, ACACA, NFATC1 F3 1480/4885SIRT5 976/4885CYP3A4 2588/4885
US-20030039705-A1 Triterpene compositions and methods for use thereof BAX, CASP3, ACACA F3 812/4885SIRT5 1409/4885CYP3A4 1739/4885
US-20060148732-A1 Inhibition of NF-kappaB by triterpene compositions NFKBIA, NFKB2, RELA F3 533/4885SIRT5 2228/4885CYP3A4 3607/4885
US-20030054052-A1 Triterpene compositions and methods for use thereof OSTC, ACACA, NFATC1 F3 1480/4885SIRT5 976/4885CYP3A4 2588/4885

“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.

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