SCHEMBL28980697

SCHEMBL28980697

CCOB(OCC)c1ccccc1CC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
LIPG Q9Y5X9 1/20 0.36
MGLL Q99685 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
ENPP2 Q13822 1/20 0.33
TSHR P16473 2/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ORAI1 Q96D31 1/20 0.32
ORAI2 Q96SN7 1/20 0.32
ORAI3 Q9BRQ5 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
SCHEMBL21567696 0.78 ENPP2 (0.55) L3MBTL1MAPTALDH1A1HTTENPP2
SCHEMBL22000805 0.77 TSHR (0.38) MAPTALDH1A1GAAHTTTSHR
SCHEMBL20312338 0.75 ALDH1A1 (0.45) L3MBTL1MAPTALDH1A1GAATSHR
SCHEMBL7631503 0.75 GABRA1 (0.44) L3MBTL1MAPTNPSR1GABRA1GABRB2
SCHEMBL12419301 0.73 GABRA1 (0.42) L3MBTL1MAPTNPSR1GABRA1GABRB2
SCHEMBL29468961 0.73 LIPG (0.61) MAPTGABRA1GABRB2LIPGMGLL
SCHEMBL410387 0.73 LIPG (0.61) MAPTGABRA1GABRB2LIPGMGLL
SCHEMBL20312352 0.72 MAPT (0.34) L3MBTL1MAPTLIPGALDH1A1GAA
SCHEMBL5951898 0.72 HPGD (0.40) ALDH1A1TSHRKMT2AKDM4E
SCHEMBL20312341 0.72 ALDH1A1 (0.48) L3MBTL1MAPTALDH1A1GAAHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115928264-A Preparation method of metal-containing near-stoichiometric continuous silicon carbide fiber 湖南泽睿新材料有限公司 2023-04-07 CN claimed
CN-115928264-A Preparation method of metal-containing near-stoichiometric continuous silicon carbide fiber 湖南泽睿新材料有限公司 2023-04-07 CN disclosed