SCHEMBL29237462

SCHEMBL29237462

C[Si](C)(C)CCOC(=O)Cc1cccc(Br)c1F

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
P2RX7 Q99572 1/20 0.33
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
CYP2D6 P10635 1/20 0.32
ATM Q13315 1/20 0.31
SSTR4 P31391 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
SCHEMBL671835 0.81 PKM (0.44) ALDH1A1MEN1KMT2APTGS1PTGS2
SCHEMBL31053240 0.81 PKM (0.44) ALDH1A1MEN1KMT2APTGS1PTGS2
SCHEMBL31284578 0.78 KDM4E (0.43) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL27984139 0.78 KDM4E (0.43) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL8661829 0.75 CDYL (0.40) ALDH1A1
SCHEMBL29993025 0.73 L3MBTL1 (0.40) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL27094100 0.73 L3MBTL1 (0.40) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL30967883 0.71 KDM4E (0.38) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL29336965 0.71 KDM4E (0.38) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL14499487 0.71 P2RX7 (0.44) MEN1MAPTKMT2ATAAR1P2RX7

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
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 CN disclosed