SCHEMBL7658829

SCHEMBL7658829

CC(C)=CCN1C(=O)C(C(=O)Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.53
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
F2 P00734 1/20 0.43
PLG P00747 1/20 0.43
ELANE P08246 1/20 0.43
CTSG P08311 1/20 0.43
CMA1 P23946 1/20 0.43
CTRC Q99895 1/20 0.43
MAPT P10636 1/20 0.40
HDAC6 Q9UBN7 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 2/20 0.37
RAB9A P51151 1/20 0.37
ABCB11 O95342 1/20 0.36
LMNA P02545 1/20 0.36
PTGS1 P23219 1/20 0.36

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
SCHEMBL7651041 0.95 EP300 (0.45) EP300KMT2AMEN1F2PLG
SCHEMBL7658228 0.87 EP300 (0.50) EP300KMT2AMEN1F2PLG
SCHEMBL7655852 0.87 EP300 (0.46) EP300KMT2AMEN1F2PLG
SCHEMBL7657008 0.87 EP300 (0.68) EP300KMT2AMEN1F2PLG
SCHEMBL7660452 0.85 CCKBR (0.39) EP300MAPTPOLBABCB11LMNA
SCHEMBL7839682 0.81 LMNA (0.36) EP300KMT2AMEN1MAPTPOLB
SCHEMBL7665537 0.78 EP300 (0.53) EP300KMT2AMEN1F2PLG
SCHEMBL11375405 0.77 EP300 (0.69) EP300KMT2AMEN1F2PLG
SCHEMBL7665570 0.76 MAPT (0.39) KMT2AMEN1MAPTPOLBRAB9A
SCHEMBL7651051 0.75 EP300 (0.56) EP300KMT2AMEN1F2PLG

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 4 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 claimed
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