SCHEMBL20680904

SCHEMBL20680904

CC(C)(C)[Si](OCCc1csc(S(=O)(=O)Cl)n1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
SMYD2 Q9NRG4 2/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL20680966 0.85 LMNA (0.34) LMNARAB9ASMYD2CYP3A4HTT
SCHEMBL8172907 0.80 SMYD2 (0.33) LMNARAB9ASMYD2CYP3A4HTT
SCHEMBL19475289 0.73
SCHEMBL30298270 0.73 SMYD2 (0.33) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL20681067 0.72 LOXL2 (0.39)
SCHEMBL1812544 0.69 MMP2 (0.45) LMNASMN1; SMN2
SCHEMBL30298260 0.69 SMYD2 (0.32) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL28377643 0.69 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL8172914 0.68 MAPT (0.37) RAB9ASMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL8194770 0.68 TAAR1 (0.39) SMYD2CYP3A4HTTSMN1; SMN2

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-3658539-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis Inflammasome Research, Inc. (US) 2020-06-03 EP disclosed
WO-2019023147-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY IFM Tre, Inc. (US) 2019-01-31 WO disclosed