SCHEMBL8344939

SCHEMBL8344939

O=C(NCc1ccccc1)C(Cc1ccccc1)NC(=O)[C@H]1O[C@@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 9/20 0.56
MMP1 P03956 8/20 0.56
ANPEP P15144 1/20 0.53
CAPN1 P07384 5/20 0.52
MMP8 P22894 2/20 0.51
PSMB5 P28074 1/20 0.46

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
SCHEMBL7762736 1.00 FCER2 (0.56) FCER2MMP1ANPEPCAPN1MMP8
SCHEMBL7762727 1.00 FCER2 (0.56) FCER2MMP1ANPEPCAPN1MMP8
SCHEMBL8397400 0.94 ANPEP (0.54) FCER2MMP1ANPEPMMP8PSMB5
SCHEMBL7207278 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL8343183 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL7207282 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL7762722 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL7762733 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL8348444 0.88 KMT2A (0.54) CAPN1MMP8PSMB5
SCHEMBL7206720 0.86 L3MBTL1 (0.59) CAPN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883121-A INHIBITING ACTIVITY AGAINST CATHEPSIN, AND IS USEFUL FOR PREVENTION AND TREATMENT OF OSTEOPATHY SUCH AS OSTEOPOROSIS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-03-16 US disclosed