SCHEMBL4506884

SCHEMBL4506884

[NH]C(=S)Nc1cc2ccccc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.45
▸ FLT3 P36888 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ AOC3 Q16853 2/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ DAO P14920 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ SRD5A2 P31213 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ DDO Q99489 1/20 0.41
▸ IDO1 P14902 2/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL3068361 0.84 GRIK1 (0.49) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL3082016 0.82 GRIK1 (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL4506889 0.82 AOC3 (0.46) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL5515054 0.82 GRIK1 (0.51) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL927313 0.79 AOC3 (0.46) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL8118597 0.78 KDM4E (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL9269321 0.76 GRIK1 (0.56) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL3073852 0.75 GRIK1 (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL5493171 0.75 KDM4E (0.51) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL31487774 0.75 MTNR1A (0.53) GRIK1FLT3NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233960-A1 Kinase Inhibitors DEVGEN NV (BE) 2009-09-17 — — US disclosed
EP-1934181-A2 KINASE INHIBITORS Devgen NV (BE) 2008-06-25 — — EP disclosed
WO-2007042321-A2 KINASE INHIBITORS DEVGEN N.V. (BE) 2007-04-19 — — WO 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-20090233960-A1 Kinase Inhibitors ROCK1, MAP3K1, MAP3K11 GRIK1 419/4885FLT3 395/4885NPC1 1514/4885

“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.

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