SCHEMBL4873887

SCHEMBL4873887

Cc1cc(C(=NO)c2ccc(F)cc2Cl)cn(-c2c(Cl)cccc2Cl)c1=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CHRNA7 P36544 3/20 0.34
RORC P51449 2/20 0.34
CLCN2 P51788 1/20 0.33
AVPR2 P30518 1/20 0.33
OXTR P30559 1/20 0.33
AVPR1A P37288 1/20 0.33
MAPK14 Q16539 1/20 0.33
TYMP P19971 1/20 0.33
HSD11B1 P28845 1/20 0.33
PMM2 O15305 1/20 0.33
MPI P34949 1/20 0.33
PHOSPHO1 Q8TCT1 1/20 0.33
NOTUM Q6P988 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL4873882 1.00 P2RX7 (0.35) P2RX7KDM4EPOLBHSP90AA1CHRNA7
SCHEMBL4877832 0.83 HSD11B1 (0.37) P2RX7KDM4EPOLBHSP90AA1RORC
SCHEMBL4877829 0.83 HSD11B1 (0.37) P2RX7KDM4EPOLBHSP90AA1RORC
SCHEMBL4876311 0.76 MAPK14 (0.39) P2RX7RORCMAPK14
SCHEMBL4876312 0.76 MAPK14 (0.39) P2RX7RORCMAPK14
SCHEMBL4875277 0.75 NOTUM (0.43) KDM4EPOLBMAPK14NOTUM
SCHEMBL4875271 0.75 NOTUM (0.43) KDM4EPOLBMAPK14NOTUM
SCHEMBL4878352 0.73 MAPK14 (0.35) P2RX7KDM4EPOLBRORCMAPK14
SCHEMBL4878366 0.73 MAPK14 (0.35) P2RX7KDM4EPOLBRORCMAPK14
SCHEMBL4924074 0.70 MAPK14 (0.41) P2RX7RORCMAPK14MEN1KMT2A

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
US-20080081825-A1 Nitrogen-Containing Heterocyclic Compounds and Medicinal Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-04-03 US disclosed
EP-1741702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 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 (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-20080081825-A1 Nitrogen-Containing Heterocyclic Compounds and Medicinal Use Thereof MAPK1, NOS1, NOS2 P2RX7 340/4885KDM4E 3574/4885POLB 2203/4885

“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.