SCHEMBL8425633

SCHEMBL8425633

C[Si](C)(C)CC(=O)SC1CCN(C(=O)OCc2ccc([N+](=O)[O-])cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GRIN2B Q13224 1/20 0.38
ATM Q13315 1/20 0.38
KCNJ1 P48048 1/20 0.38
KCNH2 Q12809 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
SCHEMBL8425629 1.00 ALDH1A1 (0.41) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL195525 0.88 ALDH1A1 (0.44) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL6398790 0.82 SMN1; SMN2 (0.46) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL6398117 0.82 SMN1; SMN2 (0.46) ALDH1A1MAPTLMNASMN1; SMN2TDP1
SCHEMBL10817448 0.82 TDP1 (0.40) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL10813302 0.79 ALDH1A1 (0.46) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL5723978 0.78 ALDH1A1 (0.47) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL4476414 0.78 ALDH1A1 (0.47) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL5723982 0.78 ALDH1A1 (0.47) ALDH1A1MAPTLMNASMN1; SMN2DPP8
SCHEMBL6774275 0.78 KDM4E (0.41) ALDH1A1MAPTLMNASMN1; SMN2DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5856556-A Azetidinone derivatives, a process for their preparation and their use as intermediates in the preparation of carbapenem antibiotics SANKYO COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0102239-B1 AZETIDINONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS INTERMEDIATES IN THE PREPARATION OF CARBAPENEM ANTIBIOTICS SANKYO COMPANY LIMITED (JP) 1987-10-14 EP disclosed
EP-0102239-A1 Azetidinone derivatives, a process for their preparation and their use as intermediates in the preparation of carbapenem antibiotics SANKYO COMPANY LIMITED (JP) 1984-03-07 EP disclosed