SCHEMBL28916379

SCHEMBL28916379

O=C(Nc1cc(-c2ccccc2)cc(C(F)(F)F)c1Cl)c1cc(Cl)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 13/20 0.60
▸ KCNMA1 Q12791 2/20 0.53
▸ P2RX1 P51575 4/20 0.52
▸ P2RX4 Q99571 3/20 0.52
▸ P2RX7 Q99572 3/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ IKBKB O14920 1/20 0.52
▸ CHUK O15111 1/20 0.52
▸ KDR P35968 1/20 0.52
▸ FLT3 P36888 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ MYLK Q15746 1/20 0.52
▸ MAP4K5 Q9Y4K4 1/20 0.52
▸ SLC2A1 P11166 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.51
▸ ACLY P53396 1/20 0.50
▸ TAS1R3 Q7RTX0 1/20 0.49
▸ TAS1R1 Q7RTX1 1/20 0.49
▸ TAS1R2 Q8TE23 1/20 0.49

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
SCHEMBL28916388 0.90 TMPRSS4 (0.58) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL28916938 0.89 TMPRSS4 (0.65) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL14886093 0.83 TMPRSS4 (0.76) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL28916373 0.82 TMPRSS4 (0.65) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL30771738 0.82 TMPRSS4 (0.73) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL329995 0.82 TMPRSS4 (0.73) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL4264823 0.79 TMPRSS4 (0.72) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL14886017 0.79 TMPRSS4 (0.65) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL28916402 0.78 TMPRSS4 (0.77) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL30087008 0.78 TMPRSS4 (0.77) TMPRSS4P2RX1P2RX4P2RX7MEN1

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-115504902-A 5-chloro salicylamide derivatives, preparation method thereof and application thereof as medicaments 广东药科大学 2022-12-23 — — CN claimed
CN-115504902-A 5-chloro salicylamide derivatives, preparation method thereof and application thereof as medicaments 广东药科大学 2022-12-23 — — CN disclosed
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