SCHEMBL7035560

SCHEMBL7035560

CCOC(=O)CC1=C(C)Cc2cc(F)c(O[Si](C)(C)C(C)(C)C)cc21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.42
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
BRD4 O60885 1/20 0.31
STING1 Q86WV6 2/20 0.30
NLRP3 Q96P20 1/20 0.30
LMNA P02545 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
SCHEMBL7032828 0.80 NR4A1 (0.35) SMN1; SMN2BRD4NLRP3LMNA
SCHEMBL6932963 0.75 GAA (0.40) LMNA
SCHEMBL7041034 0.73 TK2 (0.32) SMN1; SMN2BRD4LMNA
SCHEMBL7038339 0.72 DRD2 (0.37) DRD2
SCHEMBL6936638 0.72 HSP90AB1 (0.36) SMN1; SMN2NLRP3LMNA
SCHEMBL11663434 0.71 LMNA (0.37) STING1LMNA
SCHEMBL1363327 0.69 DRD2 (0.48) DRD2SMN1; SMN2LMNA
SCHEMBL10452032 0.68 ALDH1A1 (0.41) DRD2CYP11B1CYP11B2SMN1; SMN2
SCHEMBL23218907 0.67 DRD2 (0.49) DRD2SMN1; SMN2LMNA
SCHEMBL8686339 0.67 PPARG (0.36) LMNA

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-2003003012-A1 IDENTIFICATION OF INTERACTING MOLECULES MEDIMOLECULAR PTY. LTD. (AU) 2003-01-09 WO disclosed