SCHEMBL11053496

SCHEMBL11053496

CC(=O)Oc1ccc(CC(C)(C)O[SiH3])cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
ELANE P08246 3/20 0.45
MAPT P10636 3/20 0.43
POLB P06746 2/20 0.43
PKM P14618 1/20 0.43
HSD17B10 Q99714 1/20 0.41
ESR1 P03372 1/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CHRM1 P11229 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HSP90AA1 P07900 1/20 0.40
KMT2A Q03164 3/20 0.39
CYP3A4 P08684 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39

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
SCHEMBL12556696 0.82 LMNA (0.53) LMNAELANEMAPTPOLBPKM
SCHEMBL5733364 0.79 LMNA (0.50) LMNAELANEMAPTPOLBPKM
SCHEMBL6428739 0.79 LMNA (0.50) LMNAELANEMAPTPOLBPKM
SCHEMBL28929603 0.79 ELANE (0.37) LMNAELANEESR1CYP3A4
SCHEMBL3482290 0.77 IDO1 (0.47) CHRM2ALDH1A1CYP3A4SMN1; SMN2TP53
SCHEMBL25596139 0.77 BLM (0.47) LMNAELANEMAPTPOLBPKM
SCHEMBL22033171 0.75 BLM (0.63) LMNAELANEMAPTPOLBPKM
SCHEMBL22033169 0.75 BLM (0.63) LMNAELANEMAPTPOLBPKM
SCHEMBL12907824 0.74 LMNA (0.57) LMNAELANEMAPTPOLBPKM
SCHEMBL8491271 0.74 MAPT (0.49) LMNAELANEMAPTPOLBPKM

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
US-4469409-A Homogeneous alignment layer for liquid crystal display device HITACHI, LTD. (JP) 1984-09-04 US disclosed