SCHEMBL7739867

SCHEMBL7739867

CCOCOCC(CC(Cc1cccnc1)C(=O)NO)NC(=O)c1cccc(C)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
GPR132 Q9UNW8 11/20 0.40
CTSL P07711 1/20 0.40
CTSS P25774 1/20 0.40
VNN1 O95497 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PIN1 Q13526 1/20 0.39
CMKLR2 P46091 1/20 0.39
CMKLR1 Q99788 1/20 0.39
GRM5 P41594 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ECE1 P42892 1/20 0.38

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
SCHEMBL7739872 1.00 LMNA (0.43) LMNATAS1R3TAS1R1GPR132CTSL
SCHEMBL7740453 0.91 MMP13 (0.43) LMNAGPR132CTSLCTSSKDM4E
SCHEMBL7740451 0.91 MMP13 (0.43) LMNAGPR132CTSLCTSSKDM4E
SCHEMBL7741296 0.87 KMT2A (0.41) LMNAGPR132CTSLCTSSECE1
SCHEMBL7741294 0.87 KMT2A (0.41) LMNAGPR132CTSLCTSSECE1
SCHEMBL7741077 0.86 GAA (0.48) LMNATAS1R3TAS1R1GPR132
SCHEMBL7741080 0.86 GAA (0.48) LMNATAS1R3TAS1R1GPR132
SCHEMBL7741005 0.85 LMNA (0.38) LMNAKDM4EECE1
SCHEMBL7741001 0.85 LMNA (0.38) LMNAKDM4EECE1
SCHEMBL7734685 0.84 SMN1; SMN2 (0.41) LMNA

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-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP claimed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed