SCHEMBL7657008

SCHEMBL7657008

O=C(Cc1ccccc1)C1C(=O)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.68
F2 P00734 1/20 0.56
PLG P00747 1/20 0.56
ELANE P08246 1/20 0.56
CTSG P08311 1/20 0.56
CMA1 P23946 1/20 0.56
CTRC Q99895 1/20 0.56
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.45
EHMT2 Q96KQ7 1/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
MGLL Q99685 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL7665537 0.87 EP300 (0.53) EP300F2PLGELANECTSG
SCHEMBL7658829 0.87 EP300 (0.53) EP300F2PLGELANECTSG
SCHEMBL7651051 0.86 EP300 (0.56) EP300F2PLGELANECTSG
SCHEMBL7656125 0.83 EP300 (0.56) EP300F2PLGELANECTSG
SCHEMBL11375405 0.82 EP300 (0.69) EP300F2PLGELANECTSG
SCHEMBL7651075 0.82 EP300 (0.61) EP300F2PLGELANECTSG
SCHEMBL7651041 0.80 EP300 (0.45) EP300F2PLGELANECTSG
SCHEMBL6841466 0.79 ALDH1A1 (0.53) EP300KMT2AMEN1MAPTALDH1A1
SCHEMBL7664138 0.76 EP300 (0.53) EP300F2PLGELANECTSG
Thiophene SCHEMBL27544626 0.75 EP300 (0.59) EP300F2PLGELANECTSG

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 5 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
CN-1295565-A Barbituric acid derivative and preventive and therapeutic agent for bone and cartilage containing the same HOECHST MARION ROUSSEL INC (FR) 2001-05-16 CN 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