SCHEMBL4871148

SCHEMBL4871148

Cc1cc(CON=C(c2ccc(=O)n(-c3c(Cl)cccc3Cl)c2)c2ccc(F)cc2F)no1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
PKM P14618 1/20 0.34
MAPK14 Q16539 5/20 0.33
POLB P06746 2/20 0.32
CHRNA7 P36544 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NAMPT P43490 1/20 0.31
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL4871144 1.00 NPC1 (0.34) NPC1RAB9APKMMAPK14POLB
SCHEMBL4873533 0.87 CHRNA7 (0.34) NPC1RAB9AMAPK14CHRNA7L3MBTL1
SCHEMBL4873528 0.87 CHRNA7 (0.34) NPC1RAB9AMAPK14CHRNA7L3MBTL1
SCHEMBL5182329 0.86 MAPK14 (0.35) NPC1RAB9AMAPK14CHRNA7MAPK13
SCHEMBL5182325 0.86 MAPK14 (0.35) NPC1RAB9AMAPK14CHRNA7MAPK13
SCHEMBL4873178 0.84 MAPK14 (0.35) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4873184 0.84 MAPK14 (0.35) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4879567 0.84 MAPK14 (0.35) RAB9AMAPK14CHRNA7L3MBTL1MAPK13
SCHEMBL4879572 0.84 MAPK14 (0.35) RAB9AMAPK14CHRNA7L3MBTL1MAPK13
SCHEMBL4879615 0.84 MAPK14 (0.34) MAPK14CHRNA7MAPK13MAPK12MAPK11

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 NPC1 1526/4885RAB9A 1257/4885PKM 783/4885

“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.