SCHEMBL20569830

SCHEMBL20569830

C[SiH](C)C(C)(C)COCCCCCOc1ccc2cc(Br)ccc2c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
HDAC1 Q13547 1/20 0.36
HRH3 Q9Y5N1 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NCEH1 Q6PIU2 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM1A O60341 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL4665393 0.84 LMNA (0.40) KDM4EMAPK1NPC1RAB9AMAPT
SCHEMBL5922464 0.84 ALDH1A1 (0.47) KDM4ERAB9AMAPTALDH1A1LMNA
SCHEMBL2474079 0.80 KDM4E (0.49) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL1284438 0.77 MAOB (0.45) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23036465 0.77 LMNA (0.34) KDM4EMAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL4748690 0.75 NR5A1 (0.51) MAPT
SCHEMBL7210942 0.75 NR5A1 (0.51) MAPT
SCHEMBL4749149 0.75 NR5A1 (0.51) MAPT
SCHEMBL4745433 0.75 NR5A1 (0.51) MAPT
SCHEMBL9699146 0.75 NR5A1 (0.51) MAPT

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-2018216822-A1 NOVEL IMIDAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-11-29 WO disclosed