SCHEMBL609982

SCHEMBL609982

Cc1nc(Cl)cc(CS)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
HSP90AB1 P08238 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
MAPT P10636 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
SCHEMBL20840575 0.82 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL29770781 0.80 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL2632832 0.80 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL4258600 0.78 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL18971574 0.77 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL3802657 0.77 ALDH1A1 (0.46) ALDH1A1RAB9AHTTKDM4EMAPT
SCHEMBL113085 0.75
SCHEMBL27724937 0.75 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AGAANPSR1
SCHEMBL27792582 0.72 ALDH1A1 (0.46) ALDH1A1GAANPC1RAB9ASMN1; SMN2
SCHEMBL604508 0.72 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176222-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-11-05 EP disclosed
US-8598365-B2 Herbicides SYNGENTA LIMITED (GB) 2013-12-03 US disclosed
US-8541594-B2 2013-09-24 US disclosed
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 US 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-20120040826-A1 NOVEL HERBICIDES DDT, HDHD5, DDC ALDH1A1 294/4885MEN1 4762/4885KMT2A 752/4885

“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.