SCHEMBL7740934

SCHEMBL7740934

CCOCOC[C@H](C[C@H](COC)C(=O)NO)NC(=O)c1ccc([N+](=O)[O-])s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 4/20 0.37
POLB P06746 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.36
CTSS P25774 1/20 0.36
ATM Q13315 1/20 0.35
CASP3 P42574 2/20 0.35
SENP8 Q96LD8 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
TDP2 O95551 1/20 0.35
DNMT1 P26358 1/20 0.35
GALK1 P51570 1/20 0.35
CASP9 P55211 1/20 0.35
CASP6 P55212 1/20 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
SCHEMBL7740928 1.00 LMNA (0.39) LMNASMN1; SMN2MEN1KMT2AHTT
SCHEMBL7734802 0.86 ALDH1A1 (0.37) LMNASMN1; SMN2MEN1KMT2AHTT
SCHEMBL7734808 0.86 ALDH1A1 (0.37) LMNASMN1; SMN2MEN1KMT2AHTT
SCHEMBL6298320 0.82 USP21 (0.40) LMNASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL7740508 0.82 USP21 (0.40) LMNASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL6298324 0.82 USP21 (0.40) LMNASMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL7740628 0.78 USP21 (0.39) LMNASMN1; SMN2MEN1KMT2APOLB
SCHEMBL7740631 0.78 USP21 (0.39) LMNASMN1; SMN2MEN1KMT2APOLB
SCHEMBL7735014 0.77 HPGD (0.43) LMNAKMT2AHTTALDH1A1
SCHEMBL6305524 0.77 HPGD (0.43) LMNAKMT2AHTTALDH1A1

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