SCHEMBL27571925

SCHEMBL27571925

C1=CC([Zr](Oc2cccc(Oc3ccccc3)c2)(Oc2cccc(Oc3ccccc3)c2)C2C=CC=C2)C=C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.43
LTA4H P09960 3/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MITF O75030 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.40
NLRP1 Q9C000 1/20 0.40
NOD2 Q9HC29 1/20 0.40
AKR1C3 P42330 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 1/20 0.36
NLRP3 Q96P20 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL27545339 0.87 LTA4H (0.46) LTA4HTSHRMEN1KMT2ANPC1
SCHEMBL27519182 0.83 LTA4H (0.36) LTA4HTSHR
SCHEMBL27518619 0.83 FABP7 (0.36) LTA4H
Hydrochloric Acid SCHEMBL31634566 0.81 LTA4H (0.35) LTA4HTSHR
SCHEMBL27566796 0.81 ACHE (0.42) MAOBALDH1A1SMN1; SMN2
SCHEMBL27518640 0.79 HRH1 (0.38) MAOBLTA4HPPARG
SCHEMBL28743095 0.79 MEN1 (0.46) TSHRMEN1KMT2AALDH1A1GAA
SCHEMBL27536862 0.78 STS (0.50) MEN1KMT2AALDH1A1AKR1C3NPC1
SCHEMBL28742958 0.77 ACHE (0.47) MEN1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL28743571 0.77 MAOB (0.40) MAOBKMT2AALDH1A1GAAMAPT

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-1259963-A Catalytic components for polymerization of olefins, catalyst and process for the polymerization MARUZEN PETROCHEM CO LTD (JP) 2000-07-12 CN disclosed