SCHEMBL7655852

SCHEMBL7655852

CC(C)=CCN1C(=O)C(C(=O)Cc2cccs2)C(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.46
SIGMAR1 Q99720 1/20 0.45
RAB9A P51151 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
AGTR1 P30556 1/20 0.36
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36
CMA1 P23946 1/20 0.36
CTRC Q99895 1/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 2/20 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
SCHEMBL7665570 0.92 MAPT (0.39) SIGMAR1RAB9AHPGDMEN1KMT2A
SCHEMBL7656125 0.89 EP300 (0.56) EP300SIGMAR1RAB9AHPGDMEN1
SCHEMBL7658829 0.87 EP300 (0.53) EP300RAB9AMEN1KMT2AF2
SCHEMBL7657863 0.83 MAPT (0.36) SIGMAR1RAB9AHPGDMEN1KMT2A
SCHEMBL7651041 0.82 EP300 (0.45) EP300HPGDMEN1KMT2AF2
SCHEMBL7661488 0.82 EP300 (0.46) EP300SIGMAR1RAB9AHPGDMEN1
SCHEMBL7658228 0.80 EP300 (0.50) EP300MEN1KMT2AGAAF2
SCHEMBL7841934 0.79 ALDH1A1 (0.38) SIGMAR1RAB9AHPGDMEN1KMT2A
SCHEMBL7657008 0.74 EP300 (0.68) EP300RAB9AHPGDMEN1KMT2A
SCHEMBL7660452 0.74 CCKBR (0.39) EP300POLBALDH1A1LMNAMAPT

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