SCHEMBL28821024

SCHEMBL28821024

CON=C(c1ccc(OCc2c(C)cccc2Cc2ccc(C(=O)O)cc2C(=O)O)c(C)c1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
MRGPRX4 Q96LA9 9/20 0.36
CD274 Q9NZQ7 3/20 0.35
ALDH1A1 P00352 1/20 0.34
NR1H4 Q96RI1 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL28024495 0.96 MRGPRX4 (0.38) PPARGPPARDPPARAMRGPRX4NR1H4
SCHEMBL28024484 0.88 MRGPRX4 (0.36) PPARGPPARDPPARAMRGPRX4NR1H4
SCHEMBL28024044 0.85 MRGPRX4 (0.41) PPARGPPARDPPARAMRGPRX4NR1H4
SCHEMBL28024039 0.83 MRGPRX4 (0.42) PPARAMRGPRX4CYP2C9HIF1A
SCHEMBL28024500 0.82 MRGPRX4 (0.46) PPARAMRGPRX4ALDH1A1CYP2C9HIF1A
SCHEMBL28024045 0.81 CYP2C9 (0.40) MRGPRX4CYP2C9HIF1A
SCHEMBL28024473 0.81 MRGPRX4 (0.45) PPARGPPARAMRGPRX4CYP2C9HIF1A
SCHEMBL28821202 0.81 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28097588 0.80 MRGPRX4 (0.39) PPARGPPARAMRGPRX4CYP2C9HIF1A
SCHEMBL28024071 0.80 MRGPRX4 (0.38) PPARGPPARAMRGPRX4CYP2C9HIF1A

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-104884442-A Tetrazolinone compound and applications thereof SUMITOMO CHEMICAL CO 2015-09-02 CN disclosed