SCHEMBL30079660

SCHEMBL30079660

CC1(C)OB(c2ccc3c(c2)Cc2ccccc2-3)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.47
LIPG Q9Y5X9 7/20 0.47
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ROCK1 Q13464 1/20 0.43
SRD5A2 P31213 1/20 0.41
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ADRA2A P08913 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL29265 1.00 LPL (0.47) LPLLIPGALDH1A1NPC1RAB9A
SCHEMBL20109565 0.94 LIPG (0.47) LPLLIPGALDH1A1NPC1RAB9A
SCHEMBL30860136 0.92 LIPG (0.46) LPLLIPGROCK1BACE1
SCHEMBL202622 0.92 LIPG (0.46) LPLLIPGROCK1BACE1
SCHEMBL22106330 0.88 LPL (0.38) LPLLIPGALDH1A1NPC1RAB9A
SCHEMBL22841974 0.86 MAOA (0.45) LPLLIPGALDH1A1NPC1RAB9A
SCHEMBL18164696 0.84 LPL (0.47) LPLLIPGROCK1BACE1PRMT5
SCHEMBL23767233 0.84 LPL (0.44) LPLLIPGNPC1RAB9AROCK1
SCHEMBL29851996 0.84 PGR (0.41) LPLLIPGROCK1CYP1A2HTR2C
SCHEMBL23294440 0.84 PGR (0.41) LPLLIPGROCK1CYP1A2HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058812-A Double-active-center metallocene complex and preparation method and application thereof 万华化学集团股份有限公司 2025-05-30 CN claimed
CN-120058812-A Double-active-center metallocene complex and preparation method and application thereof 万华化学集团股份有限公司 2025-05-30 CN disclosed
EP-3548535-B1 POLYMERS WITH ASYMMETRIC REPEATING UNITS MERCK PATENT GMBH (DE) 2022-11-16 EP disclosed