SCHEMBL23570087

SCHEMBL23570087

O=C(O)c1cc(CC2(Cl)CC2)cc(C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 11/20 0.48
▸ USP2 O75604 2/20 0.40
▸ NR4A2 P43354 2/20 0.40
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ RXRG P48443 1/20 0.40
▸ CES2 O00748 1/20 0.40
▸ SRD5A2 P31213 2/20 0.37

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
SCHEMBL23531157 0.84 MRGPRX4 (0.46) MRGPRX4USP2NR4A2RXRARXRB
SCHEMBL23570086 0.84 MRGPRX4 (0.46) MRGPRX4USP2NR4A2RXRARXRB
SCHEMBL23570085 0.82 MRGPRX4 (0.45) MRGPRX4USP2NR4A2RXRARXRB
SCHEMBL23570081 0.79 MRGPRX4 (0.43) MRGPRX4USP2NR4A2RXRARXRB
SCHEMBL23570082 0.78 TPMT (0.52) MRGPRX4NR4A2RXRARXRBRXRG
SCHEMBL27761970 0.76 RXRA (0.53) MRGPRX4NR4A2RXRARXRBRXRG
SCHEMBL23531175 0.76 MRGPRX4 (0.47) MRGPRX4NR4A2RXRARXRBRXRG
SCHEMBL2993355 0.74 MRGPRX4 (0.51) MRGPRX4NR4A2RXRARXRBRXRG
SCHEMBL17897037 0.74 MRGPRX4 (0.51) MRGPRX4NR4A2RXRARXRBRXRG
SCHEMBL24214278 0.73 MRGPRX4 (0.50) MRGPRX4NR4A2RXRARXRBRXRG

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
WO-2021122645-A1 PESTICIDALLY ACTIVE AZOLE-AMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-06-24 — — WO disclosed
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