SCHEMBL30228792

SCHEMBL30228792

Cc1cc(Br)ccc1SCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
ALDH1A1 P00352 6/20 0.36
POLB P06746 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 6/20 0.34
HPGD P15428 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
PABPC1 P11940 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
EIF4H Q15056 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL1989695 0.82 LMNA (0.34) PKMALDH1A1POLBMAPTL3MBTL1
SCHEMBL28999268 0.80 RAB9A (0.36) PKMALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL5199582 0.79 MAOA (0.39) PKMALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL2417409 0.77 DUT (0.34) ALDH1A1MAPTTDP1LMNADUT
SCHEMBL12002519 0.73 PYCR1 (0.39) POLBSMN1; SMN2MAPTHPGDPABPC1
SCHEMBL25259307 0.72 PKM (0.41) PKMALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL30228760 0.71 CA1 (0.39) ALDH1A1SMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL2414603 0.71 DUT (0.39) PKMALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL3863346 0.70 HTR1D (0.33) DUT
SCHEMBL8586241 0.69 DUT (0.36) ALDH1A1HPGDL3MBTL1RAB9ANPC1

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-115916756-A Sulfone derivative 豪夫迈·罗氏有限公司 2023-04-04 CN disclosed