SCHEMBL1705465

SCHEMBL1705465

COc1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)ccc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 9/20 0.74
KCNMA1 Q12791 5/20 0.62
P2RX1 P51575 4/20 0.62
P2RX4 Q99571 3/20 0.62
P2RX7 Q99572 3/20 0.62
MEN1 O00255 1/20 0.59
IKBKB O14920 1/20 0.59
CHUK O15111 1/20 0.59
KDR P35968 1/20 0.59
FLT3 P36888 1/20 0.59
KMT2A Q03164 1/20 0.59
MYLK Q15746 1/20 0.59
MAP4K5 Q9Y4K4 1/20 0.59
SLC2A1 P11166 1/20 0.59
MAPT P10636 2/20 0.56
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HIF1A Q16665 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53

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
SCHEMBL14113119 0.91 TMPRSS4 (0.60) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL330019 0.89 KCNMA1 (0.64) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL3495516 0.89 MAPT (0.69) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL330148 0.87 TMPRSS4 (0.60) TMPRSS4KCNMA1P2RX1MEN1KMT2A
SCHEMBL13812857 0.86 TMPRSS4 (0.71) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL329928 0.86 TMPRSS4 (0.71) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL330396 0.86 TMPRSS4 (0.59) TMPRSS4P2RX1MEN1KMT2AMAPT
SCHEMBL330166 0.85 TMPRSS4 (1.00) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL330296 0.85 TMPRSS4 (0.65) TMPRSS4KCNMA1P2RX1P2RX4P2RX7
SCHEMBL330394 0.84 TMPRSS4 (0.79) TMPRSS4KCNMA1P2RX1P2RX4P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263657-B2 Blocking neurokinins; using a benzene compound containing hydroxy or acetoxy group; antiinflammatory agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-09-11 US disclosed
EP-1844766-B1 Inhibitors against the production and release of inflammatory cytokines INST MED MOLECULAR DESIGN INC (JP) 2012-04-18 EP disclosed
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-07-30 US disclosed
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-12-25 US disclosed
US-20080249071-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-10-09 US disclosed
EP-1847263-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-24 EP disclosed
EP-1844766-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-17 EP disclosed
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2004-12-23 US disclosed
EP-1352650-A1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES Institute of Medicinal Molecular Design, Inc. (JP) 2003-10-15 EP 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 (4 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-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885KCNMA1 3380/4885P2RX1 1538/4885
US-20080249071-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885KCNMA1 3380/4885P2RX1 1538/4885
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885KCNMA1 3380/4885P2RX1 1538/4885
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines NFKBIA, IL1B, IKBKB TMPRSS4 3292/4885KCNMA1 2705/4885P2RX1 2316/4885

“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.