SCHEMBL112490

SCHEMBL112490

CCOC(=O)[C@@H](N)CSC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.42
METAP2 P50579 5/20 0.41
METAP1 P53582 5/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
GAA P10253 2/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CAD P27708 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
SCHEMBL12707509 1.00 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL11739657 1.00 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL110808 0.86 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL110806 0.86 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL6304330 0.86 METAP2 (0.45) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL12438531 0.86 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL110807 0.86 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL12655937 0.86 ALOX15 (0.42) ALOX15METAP2METAP1ALDH1A1LMNA
SCHEMBL9809030 0.86 METAP2 (0.37) ALOX15METAP2METAP1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL8853645 0.84 ALOX15 (0.41) ALOX15METAP2METAP1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424499-A1 STABILIZED LIPID FORMULATION OF APOPTOSIS PROMOTER Abbott Laboratories (US) 2012-03-07 EP claimed
WO-2010127193-A1 STABILIZED LIPID FORMULATION OF APOPTOSIS PROMOTER ABBOTT LABORATORIES (US) 2010-11-04 WO claimed
US-20100278905-A1 STABILIZED LIPID FORMULATION OF APOPTOSIS PROMOTER ABBVIE INC. 2010-11-04 US claimed
US-8927009-B2 ABT-263 capsule ABBVIE INC. (US) 2015-01-06 US disclosed
US-8728516-B2 Stabilized lipid formulation of apoptosis promoter ABBVIE INC. (US) 2014-05-20 US disclosed
US-8513243-B2 ABT-263 crystalline forms ABBVIE INC. (US) 2013-08-20 US disclosed
US-8362013-B2 Salt of ABT-263 and solid-state forms thereof ABBVIE INC. (US) 2013-01-29 US disclosed
US-8362014-B2 ABT-263 crystalline forms ABBVIE INC. (US) 2013-01-29 US disclosed
EP-2515883-A1 ABT-263 CAPSULE Abbott Laboratories (US) 2012-10-31 EP disclosed
EP-2477972-A1 ABT-263 CRYSTALLINE FORMS AND SOLVATES FOR USE IN TREATING BCL-2 PROTEIN RELATED DISEASES Abbott Laboratories (US) 2012-07-25 EP disclosed
EP-2442789-A1 STABLE NANOPARTICULATE DRUG SUSPENSION Abbott Laboratories (US) 2012-04-25 EP disclosed
US-7241892-B1 Hemisynthetic method and new compounds PHARMA MAR, S.A. (ES) 2007-07-10 US disclosed
US-7241892-B1 Hemisynthetic method and new compounds PHARMA MAR, S.A. (ES) 2007-07-10 US disclosed
US-7202361-B2 Antitumoral ecteinascidin derivatives PHARMAMAR (ES) 2007-04-10 US disclosed
US-7202361-B2 Antitumoral ecteinascidin derivatives PHARMAMAR (ES) 2007-04-10 US disclosed
US-5262436-A Administering; enzyme inhibitor SCHERING CORPORATION (US) 1993-11-16 US disclosed
EP-0566157-A1 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1993-10-20 EP disclosed
US-4929641-A DIURETICS, ANGIOTENSIN CONVERTING ENZYMES SCHERING CORPORATION (US) 1990-05-29 US disclosed
US-4801609-A Mercapto-acylamino acid antihypertensives SCHERING CORPORATION (US) 1989-01-31 US disclosed
EP-0254032-A2 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1988-01-27 EP 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-20100278905-A1 STABILIZED LIPID FORMULATION OF APOPTOSIS PROMOTER BCL2, BAX, BCOR ALOX15 615/4885METAP2 4253/4885METAP1 4658/4885

“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.