SCHEMBL2655264

SCHEMBL2655264

CC(=O)N[C@@H](C)c1ccc(C)cc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 18/20 0.54
ACACA Q13085 6/20 0.54

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
SCHEMBL7723690 1.00 ACACB (0.54) ACACBACACA
SCHEMBL7010951 0.87 MMP9 (0.50) ACACBACACA
SCHEMBL30202565 0.86 ACACB (0.50) ACACBACACA
SCHEMBL20791689 0.85 L3MBTL1 (0.53)
SCHEMBL13778592 0.85 ACACB (0.56) ACACBACACA
SCHEMBL20791688 0.85 L3MBTL1 (0.53)
SCHEMBL10315770 0.84 L3MBTL1 (0.45)
SCHEMBL6966307 0.83 ACACB (0.54) ACACBACACA
SCHEMBL15022611 0.83 ACACB (0.54) ACACBACACA
SCHEMBL5987917 0.82 ACACB (0.54) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180194762-A1 PYRAZOLO[3,4-b]PYRIDINE AND PYRROLO[2,3-b]PYRIDINE INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS LLC (US) 2018-07-12 US disclosed
WO-2014114578-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-31 WO disclosed
US-7592488-B2 Method for preparing optically active amines POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2009-09-22 US disclosed
US-7592488-B2 Method for preparing optically active amines POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2009-09-22 US disclosed
US-20090035830-A1 Method for Preparing Optically Active Amines POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2009-02-05 US disclosed
US-20090035830-A1 Method for Preparing Optically Active Amines POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2009-02-05 US disclosed
WO-2008027740-A2 CATALYTIC ASYMMETRIC SYNTHESIS OF PRIMARY AMINES VIA BORANE REDUCTION OF OXIME ETHERS USING SPIROBORATE ESTERS OFFICE OF INTELLECTUAL PROPERTY AND TECHNOLOGY (US) 2008-03-06 WO disclosed
US-20070078146-A1 Antiinflamamtory agents; antiarthritic agents; inflammatory bowel disorders; multiple sclerosis; asthma PHARMACIA CORPORATION 2007-04-05 US disclosed
US-20030203946-A1 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2003-10-30 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 (4 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-20180194762-A1 PYRAZOLO[3,4-b]PYRIDINE AND PYRROLO[2,3-b]PYRIDINE INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, SYK, LCK ACACB 2586/4885ACACA 3798/4885
US-20070078146-A1 Antiinflamamtory agents; antiarthritic agents; inflammatory bowel disorders; multiple sclerosis; asthma MAPK1, MAPK3, MAPK4 ACACB 3883/4885ACACA 3773/4885
US-20030203946-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR ACACB 591/4885ACACA 338/4885
US-20090035830-A1 Method for Preparing Optically Active Amines CEL, NAAA, LIPA ACACB 339/4885ACACA 255/4885

“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.