SCHEMBL594354

SCHEMBL594354

C1=CC(C2CC=CCC2)CCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL2312051 1.00 ALDH1A1 (0.35) ALDH1A1KDM4EALOX15HSD17B10
SCHEMBL6058815 0.98 ALDH1A1 (0.34) ALDH1A1KDM4EALOX15HSD17B10
SCHEMBL3095106 0.91 KDM4E (0.39) ALDH1A1KDM4E
SCHEMBL6811544 0.84 KDM4E (0.35) ALDH1A1KDM4E
SCHEMBL1289407 0.84 ALDH1A1 (0.32) ALDH1A1ALOX15
SCHEMBL11825898 0.82 KDM4E (0.33) ALDH1A1KDM4E
SCHEMBL2964675 0.81 ALDH1A1 (0.32) ALDH1A1ALOX15HSD17B10
SCHEMBL2964678 0.81 ALDH1A1 (0.32) ALDH1A1ALOX15HSD17B10
SCHEMBL5693065 0.81 ALDH1A1 (0.36) ALDH1A1ALOX15HSD17B10
SCHEMBL9988092 0.81 ALDH1A1 (0.32) ALDH1A1ALOX15HSD17B10

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2961424-A1 ADMINISTRATION OF AN ANTI-GCC ANTIBODY-DRUG CONJUGATE AND A DNA DAMAGING AGENT IN THE TREATMENT OF CANCER Millennium Pharmaceuticals, Inc. (US) 2016-01-06 EP disclosed
EP-2841103-A1 DR5 LIGAND DRUG CONJUGATES Seattle Genetics, Inc. (US) 2015-03-04 EP disclosed
WO-2014134311-A1 ADMINISTRATION OF AN ANTI-GCC ANTIBODY-DRUG CONJUGATE AND A DNA DAMAGING AGENT IN THE TREATMENT OF CANCER MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-04 WO disclosed
WO-2013163229-A1 DR5 LIGAND DRUG CONJUGATES SEATTLE GENETICS, INC. (US) 2013-10-31 WO disclosed
EP-2629801-A2 SYNERGISTIC EFFECTS BETWEEN AURISTATIN-BASED ANTIBODY DRUG CONJUGATES AND INHIBITORS OF THE PI3K-AKT MTOR PATHWAY Seattle Genetics, Inc. (US) 2013-08-28 EP disclosed
US-8389752-B2 Preparation of alicyclic diepoxides Peomerus LLC (US) 2013-03-05 US disclosed
EP-2533804-A1 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 161P2F10B PROTEINS Agensys, Inc. (US) 2012-12-19 EP disclosed
WO-2012054748-A2 SYNERGISTIC EFFECTS BETWEEN AURISTATIN-BASED ANTIBODY DRUG CONJUGATES AND INHIBITORS OF THE PI3K-AKT MTOR PATHWAY SEATTLE GENETICS, INC. (US) 2012-04-26 WO disclosed
US-8115043-B2 Method for producing cyclic olefin compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2012-02-14 US disclosed
WO-2011097627-A1 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 161P2F10B PROTEINS AGENSYS, INC. (US) 2011-08-11 WO disclosed
EP-2350062-A1 PREPARATION OF ALICYCLIC DIEPOXIDES Sumitomo Bakelite Company Limited (JP) 2011-08-03 EP disclosed
US-20100094030-A1 Preparation Of Alicyclic Diepoxides PROMERUS LLC (US) 2010-04-15 US disclosed
WO-2010042939-A1 PREPARATION OF ALICYCLIC DIEPOXIDES PROMERUS LLC (US) 2010-04-15 WO disclosed
US-20090062580-A1 Method for Producing Cyclic Olefin Compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-03-05 US disclosed
EP-2014634-A1 PROCESS FOR PRODUCTION OF CYCLIC OLEFINS Daicel Chemical Industries, Ltd. (JP) 2009-01-14 EP disclosed
US-6953812-B2 Glucagon antagonists/inverse agonists NOVO NORDISK, INC. (DK) 2005-10-11 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 (2 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-20090062580-A1 Method for Producing Cyclic Olefin Compound ADH1C, ADH1A, DHCR24 ALDH1A1 338/4885KDM4E 3346/4885ALOX15 358/4885
US-20100094030-A1 Preparation Of Alicyclic Diepoxides MVD, DLD, DHPS ALDH1A1 318/4885KDM4E 352/4885ALOX15 55/4885

“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.