SCHEMBL7060992

SCHEMBL7060992

COC(=O)C(CCc1ccc2ccccc2c1Cl)C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 3/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
MMP3 P08254 1/20 0.37
PPARG P37231 2/20 0.37
PPARD Q03181 2/20 0.37
PPARA Q07869 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ATM Q13315 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
SCHEMBL7056335 0.89 KMT2A (0.42) NCEH1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL7059752 0.88 LMNA (0.40) NCEH1LMNASMN1; SMN2MMP3MEN1
SCHEMBL7056868 0.86 ELANE (0.41) NCEH1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL7062709 0.85 NCEH1 (0.44) NCEH1LMNASMN1; SMN2MMP3PPARG
SCHEMBL7060369 0.84 MTNR1A (0.48) MEN1KMT2AATM
SCHEMBL7056410 0.81 NCEH1 (0.48) NCEH1LMNAPPARGPPARDPPARA
SCHEMBL7060692 0.74 LMNA (0.42) LMNASMN1; SMN2MEN1KMT2A
SCHEMBL7061781 0.74 PRNP (0.42) NCEH1SMN1; SMN2KMT2A
SCHEMBL7058542 0.74 NCEH1 (0.43) NCEH1MEN1KMT2A
SCHEMBL7059136 0.74 LMNA (0.45) NCEH1LMNASMN1; SMN2MMP3ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937703-B1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2003-05-21 EP disclosed
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed