SCHEMBL22499657

SCHEMBL22499657

Cc1ccc2c(c1-c1ccccc1)C=C(c1ccco1)C2[Zr]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.40
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 5/20 0.34
HSD17B10 Q99714 5/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
HPGD P15428 2/20 0.34
ALOX5 P09917 2/20 0.34
CASP1 P29466 1/20 0.34
BLM P54132 1/20 0.34
TSHR P16473 2/20 0.33
MAPT P10636 2/20 0.33
USP2 O75604 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAT2A P31153 1/20 0.32
SMARCA2 P51531 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
SCHEMBL28670274 0.85 PTGS1 (0.39) PTGS1PTGS2ALDH1A1HSD17B10MEN1
Hydrochloric Acid SCHEMBL28660011 0.84 PTGS1 (0.39) PTGS1PTGS2ALDH1A1HSD17B10MEN1
SCHEMBL22499681 0.83 CHRM2 (0.35) PTGS1PTGS2
Hydrochloric Acid SCHEMBL30312734 0.82 PTGS1 (0.39) PTGS1PTGS2ALDH1A1HSD17B10MEN1
SCHEMBL22499655 0.82 PTGS1 (0.40) PTGS1PTGS2ALDH1A1HSD17B10MEN1
SCHEMBL28660009 0.81 PTGS1 (0.38) PTGS1PTGS2ALDH1A1HSD17B10MEN1
SCHEMBL28930097 0.81 MAOA (0.31) PTGS1PTGS2
SCHEMBL28036479 0.80 SMARCA2 (0.37) PTGS1PTGS2ALDH1A1HSD17B10MEN1
SCHEMBL22499757 0.80 PTGS1 (0.39) PTGS1PTGS2ALDH1A1HSD17B10MEN1
Hydrochloric Acid SCHEMBL15863271 0.79 SMARCA2 (0.36) PTGS1PTGS2ALDH1A1HSD17B10MEN1

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-113631591-A Method for producing catalyst component for olefin polymerization, method for producing catalyst for olefin polymerization, and method for producing olefin polymer 日本聚丙烯株式会社 2021-11-09 CN disclosed
WO-2020203274-A1 PRODUCTION METHOD FOR CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, PRODUCTION METHOD FOR CATALYST FOR OLEFIN POLYMERIZATION, AND PRODUCTION METHOD FOR OLEFIN POLYMER 日本ポリプロ株式会社 2020-10-08 WO disclosed