SCHEMBL7657863

SCHEMBL7657863

CC(C)=CCN1C(=O)C(C(=O)Cc2cccs2)C(=O)N(CCC(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 5/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
ATM Q13315 1/20 0.34
PKM P14618 2/20 0.33
PSEN1 P49768 2/20 0.33
PSEN2 P49810 2/20 0.33
APH1B Q8WW43 2/20 0.33
NCSTN Q92542 2/20 0.33
APH1A Q96BI3 2/20 0.33

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
SCHEMBL7665570 0.91 MAPT (0.39) MAPTHSD17B10POLBALDH1A1HPGD
SCHEMBL7660452 0.83 CCKBR (0.39) MAPTPOLBALDH1A1LMNACCKBR
SCHEMBL7655852 0.83 EP300 (0.46) MAPTPOLBALDH1A1LMNAGAA
SCHEMBL7661488 0.83 EP300 (0.46) MAPTHSD17B10POLBALDH1A1LMNA
SCHEMBL7656836 0.79 SLC25A5 (0.35) MAPTALDH1A1GAACCKBR
SCHEMBL7841934 0.78 ALDH1A1 (0.38) MAPTHSD17B10POLBALDH1A1HPGD
SCHEMBL7656125 0.70 EP300 (0.56) POLBALDH1A1LMNAKDM4EHPGD
SCHEMBL7665537 0.69 EP300 (0.53) MAPTALDH1A1GAACYP1A2CYP2C9
SCHEMBL7658829 0.69 EP300 (0.53) MAPTPOLBLMNAMEN1KMT2A
SCHEMBL7658228 0.68 EP300 (0.50) ALDH1A1GAACYP1A2CYP2C9CYP2C19

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
US-6498164-B1 SUCH AS 1,3-DIBENZYL-5-(PHENYL- OR 2-THIENYL-ACETYL)BARBI-TURIC ACID; MALIGNANT HYPERCALCEMIA, OSTEOLYTIC DISEASES SUCH AS PAGET'S DISEASE, OSTEOPOROSIS, ARTICULAR RHEUMATISM OCCURRING IN KNEES, SHOULDERS, JOINTS AVENTIS PHARMA S.A. (FR) 2002-12-24 US disclosed
EP-1064269-A1 BARBITURIC ACID DERIVATIVE AND PREVENTIVE AND THERAPEUTIC AGENT FOR BONE AND CARTILAGE CONTAINING THE SAME Hoechst Marion Roussel (FR) 2001-01-03 EP disclosed
WO-1999050252-A2 BARBITURIC ACID DERIVATIVE AND PREVENTIVE AND THERAPEUTIC AGENT FOR BONE AND CARTILAGE CONTAINING THE SAME HOECHST MARION ROUSSEL (FR) 1999-10-07 WO disclosed