SCHEMBL29893341

SCHEMBL29893341

FC(F)(F)Oc1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 1/20 0.50
▸ MPI P34949 1/20 0.45
▸ AR P10275 1/20 0.45
▸ GRIN2B Q13224 3/20 0.45
▸ TRPV1 Q8NER1 1/20 0.44
▸ CCR6 P51684 5/20 0.43
▸ KCNH2 Q12809 3/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ GPR3 P46089 1/20 0.42
▸ MGLL Q99685 1/20 0.42
▸ WDR5 P61964 1/20 0.42
▸ RXRA P19793 1/20 0.41
▸ GRIN1 Q05586 1/20 0.41
▸ RHEB Q15382 1/20 0.41

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
SCHEMBL255377 1.00 P2RX1 (0.50) P2RX1MPIARGRIN2BTRPV1
SCHEMBL27647157 0.91 P2RX1 (0.48) P2RX1MPIARGRIN2BTRPV1
SCHEMBL3147185 0.84 GPR3 (0.50) MPIGPR3
SCHEMBL24384600 0.83 AR (0.43) P2RX1ARKCNH2WDR5RHEB
SCHEMBL7934039 0.83 AR (0.43) P2RX1ARKCNH2WDR5RHEB
SCHEMBL22407023 0.79 AR (0.46) P2RX1ARCNR1GPR3MGLL
SCHEMBL2655862 0.79 GRIN2B (0.51) GRIN2BTRPV1CCR6KCNH2
SCHEMBL2318592 0.78 WDR5 (0.42) KCNH2WDR5
SCHEMBL31421812 0.77 RXRA (0.44) P2RX1RXRA
SCHEMBL23519084 0.77 RXRA (0.44) P2RX1RXRA

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-110799490-B 3-arylpropionamide compound and method for producing 3-arylpropionate compound 住友化学株式会社 2023-05-02 — — CN disclosed
CN-112159329-B Co-production preparation method of o-amino trifluoromethoxybenzene and m-amino trifluoromethoxybenzene 大连奇凯医药科技有限公司 2022-09-06 — — CN disclosed
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