SCHEMBL330512

SCHEMBL330512

O=C(Nc1cc(Cl)c(O)c(Cl)c1)c1cc(Br)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 6/20 0.62
PLAU P00749 2/20 0.59
F2 P00734 1/20 0.57
F10 P00742 1/20 0.57
PLAT P00750 1/20 0.57
ALOX15 P16050 2/20 0.56
P2RX1 P51575 6/20 0.55
P2RX4 Q99571 3/20 0.55
P2RX7 Q99572 3/20 0.55
DHODH Q02127 1/20 0.55
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CES2 O00748 1/20 0.50
GALR3 O60755 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
EGFR P00533 1/20 0.50
LMNA P02545 1/20 0.50
ERBB2 P04626 1/20 0.50
LCK P06239 1/20 0.50

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
SCHEMBL330395 0.91 TMPRSS4 (0.62) TMPRSS4PLAUF2F10PLAT
SCHEMBL331504 0.87 HDAC3 (0.62) TMPRSS4PLAUF2F10PLAT
SCHEMBL331484 0.86 P2RX1 (0.74) TMPRSS4PLAUF2F10PLAT
Bromochlorosalicylanilide SCHEMBL152257 0.83 P2RX1 (0.77) TMPRSS4PLAUF2F10PLAT
Dibromsalan SCHEMBL646973 0.82 PLAU (0.73) TMPRSS4PLAUF2F10PLAT
Dibromsalan SCHEMBL29496335 0.82 PLAU (0.73) TMPRSS4PLAUF2F10PLAT
SCHEMBL11788294 0.82 P2RX1 (0.63) TMPRSS4P2RX1P2RX4P2RX7DHODH
SCHEMBL17407572 0.80 KMT2A (0.55) TMPRSS4PLAUF2F10PLAT
SCHEMBL330991 0.80 TMPRSS4 (0.68) TMPRSS4PLAUF2F10PLAT
SCHEMBL330461 0.80 P2RX1 (0.68) TMPRSS4PLAUF2F10PLAT

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 10 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
US-8097759-B2 Inflammatory cytokine release inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-01-17 US disclosed
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2010-10-28 US 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 (5 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-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1813/4885PLAU 1829/4885F2 2537/4885
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885PLAU 1570/4885F2 2421/4885
US-20080249071-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885PLAU 1570/4885F2 2421/4885
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A TMPRSS4 1647/4885PLAU 1570/4885F2 2421/4885
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines NFKBIA, IL1B, IKBKB TMPRSS4 3292/4885PLAU 2016/4885F2 2533/4885

“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.