SCHEMBL8726264

SCHEMBL8726264

C=CCN1C(=O)NC(C(C)CC)C1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 5/20 0.45
CYP3A4 P08684 4/20 0.45
MAPT P10636 3/20 0.45
CYP2C9 P11712 3/20 0.45
CYP2C19 P33261 3/20 0.45
POLB P06746 2/20 0.45
CYP1A2 P05177 2/20 0.45
GAA P10253 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 2/20 0.39
GLA P06280 1/20 0.34
HTT P42858 1/20 0.34
APLNR P35414 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CASP3 P42574 1/20 0.32

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
SCHEMBL8726301 0.85 MEN1 (0.49) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL8726512 0.75 ALDH1A1 (0.46) KMT2AALDH1A1CYP3A4MAPTCYP2C9
SCHEMBL8726354 0.72 MEN1 (0.75) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL10602259 0.72 ALDH1A1 (0.46) ALDH1A1CYP3A4MAPTCYP2C9CYP2C19
SCHEMBL8726551 0.72 MAPT (0.71) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL26948735 0.70 MEN1 (0.48) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL25069358 0.66 ALDH1A1 (0.45) ALDH1A1CYP3A4MAPTCYP2C9CYP2C19
SCHEMBL29717170 0.64 KDM4E (0.47) ALDH1A1CYP3A4MAPTCYP2C9CYP2C19
SCHEMBL16500668 0.64 KDM4E (0.47) ALDH1A1CYP3A4MAPTCYP2C9CYP2C19
SCHEMBL6466586 0.64 KDM4E (0.47) ALDH1A1CYP3A4MAPTCYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5766556-A SUITABLE ENVIRONMENT FOR SIMULTANEOUS SYNTHESIS OF ORGANIC COMPOUNDS, INORGANIC COMPOUNDS AND ORGANOMETALLIC COMPOUNDS WARNER-LAMBERT COMPANY (US) 1998-06-16 US disclosed
US-5714127-A RESERVOIR RACKS WITH REACTION WELLS; GAS DISPERSION TUBES CONTAINING FILTERS; HOLDER BLOCK WITH APERTURES; MANIFOLD WARNER-LAMBERT COMPANY (US) 1998-02-03 US disclosed
US-5702672-A REACTION TUBE COMPRISING GAS DISPERSION TUBE HAVING GROUNG GLASS JOINT SECTION WARNER-LAMBERT COMPANY (US) 1997-12-30 US disclosed
US-5612002-A SYNTHESIS OF COMPOUNDS WARNER-LAMBERT COMPANY (US) 1997-03-18 US disclosed
US-5593642-A CONTAINMENT OF SOLID SUPPORT WITHIN A GAS DISPERSION TUBE WARNER-LAMBERT COMPANY (US) 1997-01-14 US disclosed
US-5582801-A HAVING PLURALITY OF REACTION TUBES WITH FILTERS ON LOWER ENDS, RESERVOIR WITH MEANS FOR RECEIVING FILTERS, HOLDER FOR SUPPORTING TUBES, MANIFOLD ENCLOSING UPPER ENDS, FASTENERS HOLDING TOGETHER HOLDER AND MANIFOLD, HOLDER AND RESERVOIR WARNER-LAMBERT COMPANY (US) 1996-12-10 US disclosed
US-5567391-A MULTICOMPARTMENT CHEMICAL REACTORS WARNER-LAMBERT COMPANY (US) 1996-10-22 US disclosed
US-5565173-A USED FOR SOLID-PHASE SYNTHESIS WARNER-LAMBERT COMPANY (US) 1996-10-15 US disclosed
WO-1996030393-A1 A METHOD FOR THE SYNTHESIS OF MIXTURES OF COMPOUNDS WARNER-LAMBERT COMPANY (US) 1996-10-03 WO disclosed
US-5324483-A Apparatus for multiple simultaneous synthesis WARNER-LAMBERT COMPANY (US) 1994-06-28 US disclosed