SCHEMBL4257166

SCHEMBL4257166

CC(C)(C)c1cc(C([NH])=O)cc(C(C)(C)C)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
RECQL P46063 1/20 0.59
CA2 P00918 3/20 0.54
CA1 P00915 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.52
ALDH1A1 P00352 3/20 0.52
POLB P06746 1/20 0.52
TYR P14679 1/20 0.52
NPSR1 Q6W5P4 2/20 0.52
ALOX5 P09917 2/20 0.51
PTGS1 P23219 2/20 0.51
PTGS2 P35354 2/20 0.51
GAA P10253 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
GLRA3 O75311 1/20 0.50
GLRB P48167 1/20 0.50
TNFRSF1A P19438 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GALR3 O60755 1/20 0.47

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
SCHEMBL8495448 0.82 ALOX5 (0.65) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL227202 0.80 GLRA3 (0.63) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL4448135 0.80 LMNA (0.56) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL47718 0.80 SMN1; SMN2 (0.59) LMNARECQLCA2CA1SMN1; SMN2
Hydrochloric Acid SCHEMBL1943524 0.78 GLRA3 (0.61) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL6136796 0.78 LMNA (0.55) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL10001153 0.78 LMNA (0.55) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL8659247 0.78 GLRA3 (0.61) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL9355788 0.78 GLRA3 (0.61) LMNARECQLCA2CA1SMN1; SMN2
SCHEMBL6961288 0.78 LMNA (0.55) LMNARECQLCA2CA1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1022272-B1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS SANKYO CO (JP) 2004-05-26 EP claimed
US-6432993-B1 BENZIMIDAZOLE OR IMIDAZO(4,5-B)PYRIDINE DERIVATES; IMMUNOMODULATORS; ALDOSE REDUCTASE AND LIPOXYGENASE INHIBITORS; DIABETES; PREVENTS LIPID PEROXIDATION; ANTILIPEMIC, HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 2002-08-13 US claimed
EP-1022272-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS Sankyo Company Limited (JP) 2000-07-26 EP claimed
EP-0791004-B1 ACYLATED BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PROD (US) 1999-09-08 EP claimed
US-5773420-A Acylated benzylglycosides as inhibitors of smooth muscle cell proliferation AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-30 US claimed
EP-0791004-A1 ACYLATED BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1997-08-27 EP claimed
WO-1996014325-A1 ACYLATED BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION (US) 1996-05-17 WO claimed
US-5510478-A TREATMENT OF NEUROLOGICAL ILLNESSES RELATED TO CHOLINERGIC DEFICIENCY; ALZHEIMERS'S DISEASE AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-23 US claimed
WO-2014121036-A1 5-DEUTERO-2,4-THIAZOLIDINEDIONE AND 5-DEUTERO-2,4-OXAZOLIDINEDIONE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME DEUTERX, LLC (US) 2014-08-07 WO disclosed
US-20140221369-A1 5-DEUTERO-2,4-THIAZOLIDINEDIONE AND 5-DEUTERO-2,4-OXAZOLIDINEDIONE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME DEUTERX, LLC (US) 2014-08-07 US disclosed
US-20090318454-A1 NOVEL ANTIOXIDANTS AND METHODS OF TREATMENT WEINER, CARL P 2009-12-24 US disclosed
EP-1022272-B1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS SANKYO CO (JP) 2004-05-26 EP disclosed
US-6432993-B1 BENZIMIDAZOLE OR IMIDAZO(4,5-B)PYRIDINE DERIVATES; IMMUNOMODULATORS; ALDOSE REDUCTASE AND LIPOXYGENASE INHIBITORS; DIABETES; PREVENTS LIPID PEROXIDATION; ANTILIPEMIC, HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 2002-08-13 US disclosed
EP-1022272-A1 SUBSTITUTED FUSED HETEROCYCLIC COMPOUNDS Sankyo Company Limited (JP) 2000-07-26 EP disclosed
EP-0791004-B1 ACYLATED BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PROD (US) 1999-09-08 EP disclosed
US-5773420-A Acylated benzylglycosides as inhibitors of smooth muscle cell proliferation AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-30 US disclosed
US-5162405-A Single-functional and mixtures of multi-functional oligomeric performance additive compositions and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1992-11-10 US disclosed
US-5013777-A Benzosulfonic acids as end groups of engineering thermoplastic resins; fireproofing; oxidation and UV resistances; photostabilizers ATOCHEM NORTH AMERICA, INC. (US) 1991-05-07 US disclosed
EP-0332761-A2 Single-functional and mixtures of multifunctional oligomeric performance additive compositions, and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-09-20 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 (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-20140221369-A1 5-DEUTERO-2,4-THIAZOLIDINEDIONE AND 5-DEUTERO-2,4-OXAZOLIDINEDIONE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SRD5A2, PPARD, SRD5A1 LMNA 4061/4885RECQL 2576/4885CA2 1244/4885
US-20090318454-A1 NOVEL ANTIOXIDANTS AND METHODS OF TREATMENT GPX1, SOD1, GPX4 LMNA 4750/4885RECQL 196/4885CA2 2012/4885

“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.