SCHEMBL3216146

SCHEMBL3216146

O=C(Nc1ccc(Br)c(F)c1)c1cc(Cl)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 12/20 0.71
P2RX1 P51575 10/20 0.68
P2RX4 Q99571 6/20 0.64
P2RX7 Q99572 6/20 0.64
TAS1R3 Q7RTX0 1/20 0.60
TAS1R1 Q7RTX1 1/20 0.60
TAS1R2 Q8TE23 1/20 0.60
KCNMA1 Q12791 2/20 0.57
MEN1 O00255 1/20 0.56
IKBKB O14920 1/20 0.56
CHUK O15111 1/20 0.56
KDR P35968 1/20 0.56
FLT3 P36888 1/20 0.56
KMT2A Q03164 1/20 0.56
MYLK Q15746 1/20 0.56
MAP4K5 Q9Y4K4 1/20 0.56
SLC2A1 P11166 1/20 0.56

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
SCHEMBL26096765 0.89 P2RX1 (0.76) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL18341118 0.85 P2RX1 (0.74) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL30771736 0.85 P2RX1 (0.74) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL14886085 0.83 TMPRSS4 (1.00) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL27786761 0.83 P2RX1 (0.76) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL23303861 0.82 P2RX1 (0.70) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL13189546 0.82 P2RX1 (0.70) TMPRSS4P2RX1P2RX4P2RX7TAS1R3
SCHEMBL23303643 0.82 TMPRSS4 (0.81) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL11683279 0.81 P2RX1 (0.82) TMPRSS4P2RX1P2RX4P2RX7KCNMA1
SCHEMBL30771744 0.81 P2RX1 (1.00) TMPRSS4P2RX1P2RX4P2RX7TAS1R3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives STAT6, RELA, NFKB2 TMPRSS4 3190/4885P2RX1 3116/4885P2RX4 2985/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.