SCHEMBL15944361

SCHEMBL15944361

Cc1ccc(SCCC2CC(=O)C(c3ccccc3Cl)=C(O)C2)nc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
LDHA P00338 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL15944366 0.90 NPC1 (0.33) NPC1TP53PKMSTAT3STAT1
SCHEMBL15944362 0.88 NPC1 (0.32) NPC1TP53PKMSTAT3STAT1
SCHEMBL15945526 0.86 ALDH1A1 (0.41) NPC1PKMRAB9AL3MBTL1
SCHEMBL15944264 0.82 DAO (0.30)
SCHEMBL15944443 0.81
SCHEMBL15944253 0.79
SCHEMBL15944364 0.78 KDM4E (0.34) PKM
SCHEMBL15945527 0.78 ALDH1A1 (0.41) PKMRAB9ASMN1; SMN2L3MBTL1
SCHEMBL15944441 0.78 NMT1 (0.37) MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL14234806 0.74 ALDH1A1 (0.41) PKMRAB9AL3MBTL1

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
US-9414588-B2 Herbicide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-16 US disclosed
US-20150289505-A1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed
US-9101140-B2 Cyclohexanone compounds and herbicides comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-08-11 US disclosed
US-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-14 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 (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-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME CBR3, CBR1, CYP2S1 MAPK1 2782/4885LDHA 3043/4885NPC1 4679/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 MAPK1 3874/4885LDHA 2534/4885NPC1 4490/4885

“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.