SCHEMBL29154385

SCHEMBL29154385

CCc1ccc(-c2ccccc2O)c(CC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
MAPT P10636 2/20 0.53
NPC1 O15118 1/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TRPA1 O75762 1/20 0.47
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
CSNK2A3 Q8NEV1 1/20 0.44
PDK2 Q15119 1/20 0.43
BACE1 P56817 1/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL10770170 0.89 TRPA1 (0.59) ALDH1A1MAPTNPC1LMNAMAPK1
SCHEMBL10454625 0.84 ESR2 (0.44) ALDH1A1MAPTNPC1LMNAMAPK1
SCHEMBL4288864 0.83 TRPA1 (0.57) ALDH1A1MAPTNPC1LMNAMAPK1
SCHEMBL28365590 0.82 ESR2 (0.47) ALDH1A1TRPA1HSD17B10BAZ2BBAZ2A
SCHEMBL15026755 0.82 MAPT (0.53) ALDH1A1MAPTNPC1LMNAMAPK1
SCHEMBL29362539 0.81 GABRA1 (0.50) ALDH1A1LMNACSNK2A2CSNK2BCSNK2A1
SCHEMBL980892 0.81 GABRA1 (0.50) ALDH1A1LMNACSNK2A2CSNK2BCSNK2A1
SCHEMBL17732232 0.80 ALDH1A1 (0.42) ALDH1A1MAPTNPC1LMNAMAPK1
Ammonia Solution, Strong SCHEMBL324961 0.79 GABRA1 (0.48) ALDH1A1LMNACSNK2A2CSNK2BCSNK2A1
SCHEMBL323999 0.79 GABRA1 (0.48) ALDH1A1LMNACSNK2A2CSNK2BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117551007-A Method for increasing sulfonation degree of styrene tar 万华化学集团股份有限公司 2024-02-13 CN claimed
CN-116004290-A Method for preparing coal water slurry additive by using styrene tar 万华化学(宁波)有限公司 2023-04-25 CN claimed
CN-117551007-A Method for increasing sulfonation degree of styrene tar 万华化学集团股份有限公司 2024-02-13 CN disclosed
CN-116004290-A Method for preparing coal water slurry additive by using styrene tar 万华化学(宁波)有限公司 2023-04-25 CN disclosed