SCHEMBL1467809

SCHEMBL1467809

[NH]C(=S)Nc1ccccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.61
NPC1 O15118 6/20 0.61
ALDH1A1 P00352 5/20 0.61
PKM P14618 4/20 0.61
NPSR1 Q6W5P4 4/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
GAA P10253 3/20 0.61
MAPT P10636 2/20 0.61
KDM4E B2RXH2 1/20 0.61
TP53 P04637 1/20 0.61
HPGD P15428 1/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
HSD17B10 Q99714 1/20 0.61
ATG4B Q9Y4P1 1/20 0.61
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MIF P14174 1/20 0.53
ALOX12 P18054 2/20 0.51

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
SCHEMBL11327867 0.83 RAB9A (0.66) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL2682040 0.83 RAB9A (0.71) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL8916188 0.81 RAB9A (0.63) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL29399796 0.79 RAB9A (0.61) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL5805584 0.79 RAB9A (0.61) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL224101 0.79 RAB9A (0.61) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL525427 0.79 RAB9A (0.61) RAB9ANPC1ALDH1A1PKMNPSR1
SCHEMBL569980 0.79 RAB9A (0.70) RAB9ANPC1PKMSMN1; SMN2GAA
SCHEMBL11318736 0.78 RAB9A (0.59) RAB9ANPC1ALDH1A1PKMNPSR1
Hydrochloric Acid SCHEMBL31091390 0.78 RAB9A (0.59) RAB9ANPC1ALDH1A1PKMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds BAYER CROPSCIENCE AG 2011-03-24 US disclosed
EP-2254863-A1 PESTICIDAL CONDENSED - RING ARYL COMPOUNDS Bayer CropScience AG (DE) 2010-12-01 EP disclosed
US-20090233960-A1 Kinase Inhibitors DEVGEN NV (BE) 2009-09-17 US disclosed
WO-2009112275-A1 PESTICIDAL CONDENSED - RING ARYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2009-09-17 WO 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
US-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed
EP-0978516-A1 1-CYCLOALKYL-1,8-NAPHTHYRIDIN-4-ONE DERIVATIVES WITH PHOSPHODIESTERASE IV INHIBITORY ACTIVITY SUNTORY LIMITED (JP) 2000-02-09 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 (2 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-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds DDT, PRDX4, CYP4X1 RAB9A 1859/4885NPC1 4723/4885ALDH1A1 1268/4885
US-20090233960-A1 Kinase Inhibitors ROCK1, MAP3K1, MAP3K11 RAB9A 1324/4885NPC1 1514/4885ALDH1A1 2810/4885

“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.