SCHEMBL30950622

SCHEMBL30950622

Cc1ccc(OC(=O)c2cccc(N(CC(=O)Nc3ccccc3Sc3ccccc3)S(C)(=O)=O)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 7/20 0.66
▸ LMNA P02545 3/20 0.66
▸ RECQL P46063 1/20 0.66
▸ KMT2A Q03164 4/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ USP2 O75604 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.53
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TSHR P16473 1/20 0.46
▸ TP53 P04637 1/20 0.45

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
SCHEMBL30950635 0.93 NPSR1 (0.66) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950618 0.92 NPSR1 (0.65) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950613 0.92 NPSR1 (0.65) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950626 0.91 NPSR1 (0.63) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950615 0.91 NPSR1 (0.65) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950612 0.90 NPSR1 (0.61) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950633 0.89 NPSR1 (0.74) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950624 0.88 NPSR1 (0.66) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950611 0.86 NPSR1 (0.66) NPSR1LMNARECQLKMT2AMEN1
SCHEMBL30950630 0.86 NPSR1 (0.78) NPSR1LMNARECQLKMT2AMEN1

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
WO-2024128335-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING BONE DISEASES 전남대학교산학협력단 2024-06-20 — — WO disclosed
Send feedback