SCHEMBL7738387

SCHEMBL7738387

C=CC[Si](C)(C)c1ccc(/C=C(\NC(C)=O)C(=O)OC)s1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
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
SCHEMBL7738394 1.00 MEN1 (0.31) MEN1KMT2AALDH1A1LMNA
SCHEMBL7739139 0.77 NR1H2 (0.40) MEN1KMT2AALDH1A1LMNA
SCHEMBL7739143 0.77 NR1H2 (0.40) MEN1KMT2AALDH1A1LMNA
SCHEMBL27521518 0.74 L3MBTL1 (0.40) MEN1KMT2AALDH1A1LMNA
SCHEMBL6866444 0.71 F2 (0.37) MEN1KMT2AALDH1A1LMNA
SCHEMBL7732418 0.71 ALDH1A1 (0.38) ALDH1A1
SCHEMBL7737549 0.71 NR1H2 (0.39) ALDH1A1
SCHEMBL7737554 0.71 NR1H2 (0.39) ALDH1A1
SCHEMBL7736594 0.70 KDM4E (0.36) MEN1KMT2AALDH1A1LMNA
SCHEMBL7736591 0.70 KDM4E (0.36) MEN1KMT2AALDH1A1LMNA

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
US-6416861-B1 COMBINATORIAL CHEMISTRY NORTHWESTERN UNIVERSITY 2002-07-09 US disclosed
WO-2000049022-A2 ORGANOSILICON COMPOUNDS AND USES THEREOF NORTHWESTERN UNIVERSITY (US) 2000-08-24 WO disclosed