SCHEMBL1634160

SCHEMBL1634160

CC(C)(C)NC(CC(N)=O)C(=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 4/20 0.36

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
SCHEMBL19483456 1.00 ECE1 (0.36) ECE1
SCHEMBL1633687 0.82 MAPT (0.34)
SCHEMBL17159700 0.82 ECE1 (0.46) ECE1
SCHEMBL27420074 0.82
SCHEMBL8234180 0.82 ALDH1A1 (0.36)
SCHEMBL17159699 0.82 ECE1 (0.46) ECE1
SCHEMBL13166781 0.82
SCHEMBL20117450 0.81 KMT2A (0.35) ECE1
SCHEMBL19483457 0.81 KMT2A (0.35) ECE1
Hydrochloric Acid SCHEMBL20789044 0.80 ECE1 (0.45) ECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS FIREFLY BIO, INC. 2024-02-29 US disclosed
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS FIREFLY BIO, INC. 2024-02-29 US disclosed
US-9981008-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2018-05-29 US disclosed
US-20180052952-A9 METHODS AND APPARATUS FOR DOUBLE-INTEGRATION ORTHOGONAL SPACE TEMPERING FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2018-02-22 US disclosed
US-20180052952-A9 METHODS AND APPARATUS FOR DOUBLE-INTEGRATION ORTHOGONAL SPACE TEMPERING FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2018-02-22 US disclosed
US-20160324923-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2016-11-10 US disclosed
US-9388232-B2 Apolipoprotein A-I mimics CERENIS THERAPEUTICS HOLDING SA (FR) 2016-07-12 US disclosed
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS CERENIS THERAPEUTICS HOLDING SA (FR) 2015-05-21 US disclosed
US-20140222398-A1 METHODS AND APPARATUS FOR DOUBLE-INTEGRATION ORTHOGONAL SPACE TEMPERING FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2014-08-07 US disclosed
US-8779090-B2 Methods and compositions for the treatment of heart failure and other disorders IRONWOOD PHARMACEUTICALS, INC. (US) 2014-07-15 US disclosed
US-20120283411-A9 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-11-08 US disclosed
US-20120088902-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-04-12 US disclosed
US-20120040892-A9 Methods and Compositions for the Treatment of Heart Failure and Other Disorders WELLS FARGO BANK, NATIONAL ASSOCIATION 2012-02-16 US disclosed
US-20110306125-A1 Protein Expression Methods IRONWOOD PHARMACEUTICALS, INC. (US) 2011-12-15 US disclosed
US-20110021419-A1 Methods and Compositions for the Treatment of Heart Failure and Other Disorders Ironwood Pharmaceuticals Inc. 2011-01-27 US disclosed
US-20090305993-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS IRONWOOD PHARMACEUTICALS, INC. (US) 2009-12-10 US disclosed
US-20090192083-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS IRONWOOD PHARMACEUTICALS, INC. 2009-07-30 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 (10 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-20110021419-A1 Methods and Compositions for the Treatment of Heart Failure and Other Disorders GCGR, GCG, GIPR ECE1 783/4885
US-20120040892-A9 Methods and Compositions for the Treatment of Heart Failure and Other Disorders GCGR, GCG, GIPR ECE1 783/4885
US-20120088902-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS GRPR, GCGR, GIPR ECE1 3617/4885
US-20160324923-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG ECE1 47/4885
US-20120283411-A9 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS GRPR, GCGR, GIPR ECE1 3617/4885
US-20150141330-A1 APOLIPOPROTEIN A-I MIMICS APOB, APOL1, LIPG ECE1 47/4885
US-20110306125-A1 Protein Expression Methods GUCY1B2, GUCY1A2, GUCY1B1 ECE1 2755/4885
US-20090192083-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS GRPR, GCGR, GIPR ECE1 2868/4885
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS TPX2, H1-4, MAPT ECE1 2915/4885
US-20090305993-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS GIPR, VIP, GCGR ECE1 1040/4885

“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.