SCHEMBL8799283

SCHEMBL8799283

CC(C)(C)N(Cc1ccccc1)C(=O)CC(=O)CC(O)CC#N

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 4/20 0.43
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTSS P25774 4/20 0.38
CTSL P07711 3/20 0.38
CTSB P07858 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CTSK P43235 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL8798489 1.00 MEN1 (0.50) MEN1KMT2AHTTL3MBTL1NPC1
SCHEMBL8798411 0.85 MEN1 (0.52) MEN1KMT2AHTTL3MBTL1NPC1
SCHEMBL8798417 0.85 MEN1 (0.52) MEN1KMT2AHTTL3MBTL1NPC1
SCHEMBL8797362 0.84 POLB (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8797366 0.84 POLB (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8798861 0.76 ALDH1A1 (0.42) MEN1KMT2AHTTNPC1RAB9A
SCHEMBL8798865 0.76 ALDH1A1 (0.42) MEN1KMT2AHTTNPC1RAB9A
SCHEMBL17885994 0.73 MEN1 (0.67) MEN1KMT2AHTTL3MBTL1NPC1
SCHEMBL26939090 0.73 MEN1 (0.67) MEN1KMT2AHTTL3MBTL1NPC1
SCHEMBL8797734 0.69 POLB (0.42) MEN1KMT2ANPC1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687263-B1 PROCESS FOR PREPARING (TRANS)-6- [2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER LAMBERT CO (US) 1997-07-30 EP claimed
EP-0687263-A1 NOVEL PROCESS FOR -i(TRANS)-6- 2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER LAMBERT CO (US) 1995-12-20 EP claimed
WO-1994020492-A1 NOVEL PROCESS FOR TRANS-6-[2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER-LAMBERT COMPANY (US) 1994-09-15 WO claimed
EP-0687263-B1 PROCESS FOR PREPARING (TRANS)-6- [2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER LAMBERT CO (US) 1997-07-30 EP disclosed
US-5510488-A Process for trans-6- 2-(substituted-pyrrol-1-yl)alkyl!pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1996-04-23 US disclosed
US-5489691-A Process for trans-6-(2-(substituted-pyrrol-1-yl)alkyl)pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed
US-5489690-A Process for trans-6[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed
EP-0687263-A1 NOVEL PROCESS FOR -i(TRANS)-6- 2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER LAMBERT CO (US) 1995-12-20 EP disclosed
US-5470981-A Process for trans-6-[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1995-11-28 US disclosed
US-5446054-A Process for trans-6-[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1995-08-29 US disclosed
US-5397792-A Process for trans-6-[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1995-03-14 US disclosed
WO-1994020492-A1 NOVEL PROCESS FOR TRANS-6-[2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER-LAMBERT COMPANY (US) 1994-09-15 WO disclosed
US-5342952-A Process for trans-6-[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1994-08-30 US disclosed
US-5298627-A Process for trans-6-[2-(substituted-pyrrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER-LAMBERT COMPANY (US) 1994-03-29 US disclosed