SCHEMBL3134646

SCHEMBL3134646

C=C(COC(=O)OC(C)(C)C)COC(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
ELANE P08246 1/20 0.33
DGAT1 O75907 1/20 0.32
APLNR P35414 1/20 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
SCHEMBL16593852 0.84 HDAC6 (0.33) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL12743275 0.84 BTN3A1 (0.32)
SCHEMBL28299936 0.83 ALDH1A1 (0.34) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL28423234 0.81 HDAC6 (0.32) HDAC6HDAC1HDAC2ELANE
SCHEMBL31364246 0.79 HDAC6 (0.35) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL28346522 0.79 PAM (0.36) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL28299938 0.78 ALDH1A1 (0.35) HDAC6HDAC1HDAC2DGAT1APLNR
SCHEMBL24710351 0.77 HDAC6 (0.33) HDAC6HDAC1HDAC2
SCHEMBL314306 0.76 HDAC6 (0.36) HDAC6HDAC1HDAC2ELANEDGAT1
SCHEMBL30906709 0.76 CA12 (0.41) HDAC6HDAC1HDAC2ELANEDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-11-14 US disclosed
US-12098115-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-09-24 US disclosed
US-11952327-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-04-09 US disclosed
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2024-01-25 US disclosed
WO-2018053322-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2018-03-22 WO disclosed
US-7910558-B2 therapy for gramnegative bacteria; antibiotics ENANTA PHARMACEUTICALS, INC. (US) 2011-03-22 US disclosed
US-7910558-B2 therapy for gramnegative bacteria; antibiotics ENANTA PHARMACEUTICALS, INC. (US) 2011-03-22 US disclosed
US-20100074863-A1 ANTI-INFECTIVE PYRROLIDINE DERIVATIVES AND ANALOGS ENANTA PHARMACEUTICALS, INC. 2010-03-25 US disclosed
US-20090326019-A1 3,4-BICYCLIC PYRROLIDINE ANTIVIRALS ENANTA PHARMACEUTICALS, INC. 2009-12-31 US disclosed
US-7622452-B2 C-9 alkenylidine bridged macrolides ENANTA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-7229972-B2 Semisynthetic trimethylenedioxy-erythromycin derivatives and their use in treating bacterial infections and cystic fibrosis; preparation ENANTA PHARMACEUTICALS, INC. (US) 2007-06-12 US disclosed
US-20060252713-A1 Spirocyclic bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-11-09 US disclosed
WO-2006119384-A1 SPIROCYCLIC BICYCLOLIDES ENANTA PHARMACEUTICALS, INC. (US) 2006-11-09 WO disclosed
US-20060148731-A1 11,12-Lactone bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-07-06 US disclosed
US-20060142214-A1 3,6-bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-06-29 US disclosed
US-20060142215-A1 Tetracyclic bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-06-29 US disclosed
WO-2006065721-A2 11, 12-LACTONE BICYCLOLIDES ENANTA PHARMACEUTICALS, INC. (US) 2006-06-22 WO disclosed
WO-2006065743-A2 TETRACYLIC BICYCLOLIDES ENANTA PHARMACEUTICALS, INC. (US) 2006-06-22 WO disclosed
WO-2006063039-A2 3, 6-BICYCLOLIDES ENANTA PHARMACEUTICALS, INC. (US) 2006-06-15 WO disclosed
US-20060122128-A1 3,6-Bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-06-08 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 (11 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-20060252713-A1 Spirocyclic bicyclolides ABCB11, GGPS1, AKR1C3 HDAC6 163/4885HDAC1 284/4885HDAC2 164/4885
US-20060122128-A1 3,6-Bicyclolides ABCB11, CYP2B6, CYP3A7 HDAC6 354/4885HDAC1 1200/4885HDAC2 560/4885
US-20090326019-A1 3,4-BICYCLIC PYRROLIDINE ANTIVIRALS ZC3HAV1, EIF2AK2, POLRMT HDAC6 191/4885HDAC1 291/4885HDAC2 429/4885
US-11952327-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS HDAC6 4705/4885HDAC1 4717/4885HDAC2 4661/4885
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS HDAC6 4705/4885HDAC1 4717/4885HDAC2 4661/4885
US-20060142215-A1 Tetracyclic bicyclolides ABCB11, CYP7A1, CYP51A1 HDAC6 210/4885HDAC1 520/4885HDAC2 370/4885
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS HDAC6 4705/4885HDAC1 4717/4885HDAC2 4661/4885
US-20060142214-A1 3,6-bicyclolides ABCB11, CYP2B6, CYP3A7 HDAC6 354/4885HDAC1 1200/4885HDAC2 560/4885
US-20100074863-A1 ANTI-INFECTIVE PYRROLIDINE DERIVATIVES AND ANALOGS ZC3HAV1, POLRMT, EIF2AK2 HDAC6 124/4885HDAC1 317/4885HDAC2 1092/4885
US-20060148731-A1 11,12-Lactone bicyclolides CYP51A1, ABCB11, CYP4A11 HDAC6 183/4885HDAC1 325/4885HDAC2 315/4885
US-12098115-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS HDAC6 4705/4885HDAC1 4717/4885HDAC2 4661/4885

“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.