SCHEMBL178153

SCHEMBL178153

CC[Si](CC)(CC)OC(CN(CCO)Cc1ccccc1)c1ccc(F)c(N(C(=O)O)S(C)(=O)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ACHE P22303 1/20 0.36
POLB P06746 1/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PKM P14618 1/20 0.34
NR1H3 Q13133 4/20 0.34
MAPK1 P28482 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
RORC P51449 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
SCHEMBL2240031 0.91 HTT (0.36) HTTMEN1KMT2AACHEPOLB
SCHEMBL2240036 0.91 HTT (0.36) HTTMEN1KMT2AACHEPOLB
SCHEMBL178182 0.90 KCNH2 (0.36) MEN1KMT2AACHEPOLBTSHR
SCHEMBL176925 0.84 HTT (0.40) HTTMEN1KMT2A
SCHEMBL176926 0.84 HTT (0.40) HTTMEN1KMT2A
SCHEMBL178080 0.81 KCNH2 (0.33) MEN1KMT2AACHEPOLBTSHR
SCHEMBL2240042 0.81 KCNH2 (0.33) MEN1KMT2AACHEPOLBTSHR
SCHEMBL177214 0.80 TRPV1 (0.31)
SCHEMBL176707 0.79 GRM2 (0.41) MEN1KMT2AACHEPOLBTSHR
SCHEMBL176708 0.79 GRM2 (0.41) MEN1KMT2AACHEPOLBTSHR

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
EP-2345644-A1 INDAZOLE COMPOUND Asahi Kasei Pharma Corporation (JP) 2011-07-20 EP disclosed