SCHEMBL9815162

SCHEMBL9815162

CC(C)(C)[Si](C)(C)N1C(=O)CC1Sc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 2/20 0.34
USP2 O75604 1/20 0.34
RIPK1 Q13546 1/20 0.34
F2 P00734 2/20 0.33
PRSS1 P07477 2/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
LOX P28300 1/20 0.32
MT-CO2 P00403 1/20 0.31
ALOX5 P09917 1/20 0.31
BRD4 O60885 3/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL9386008 0.82 RIPK1 (0.33) LMNAUSP2RIPK1LOXMT-CO2
SCHEMBL9656949 0.77
SCHEMBL6073850 0.75 RIPK1 (0.51) KMT2ARIPK1ALDH1A1BRD4TSHR
SCHEMBL7387880 0.75 TSHR (0.39) KMT2AMEN1USP2RIPK1ALDH1A1
SCHEMBL30259456 0.75 TSHR (0.39) KMT2AMEN1USP2RIPK1ALDH1A1
SCHEMBL10733391 0.73
SCHEMBL11276949 0.71 USP2 (0.31) LMNAUSP2
SCHEMBL9815166 0.70 USP2 (0.30) LMNAUSP2
SCHEMBL10540453 0.70
SCHEMBL10761187 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0282241-B1 BETA-LACTAM COMPOUNDS AND PRODUCTION PROCESS THEREOF Tamura, Yasumitsu (JP) 1991-08-14 EP disclosed
EP-0045198-A2 1,1-Disubstituted carba-2-penems and their production Takeda Chemical Industries, Ltd. (JP) 1982-02-03 EP disclosed