SCHEMBL15944343

SCHEMBL15944343

C#Cc1ccccc1C1=C(O)CC(CCSc2ccc(C)cc2)CC1=O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 6/20 0.32
HPGD P15428 5/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 3/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CRBN Q96SW2 1/20 0.30
HTT P42858 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
SCHEMBL14234198 0.87 LDHA (0.30)
SCHEMBL15944280 0.86 HPGD (0.39) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944365 0.84 L3MBTL1 (0.41) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944316 0.84 PKM (0.35) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944342 0.84 PKM (0.35) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944325 0.83 PKM (0.34) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944464 0.82 LMNA (0.43) KMT2APKMALDH1A1HPGDCYP3A4
SCHEMBL15944348 0.82 ALDH1A1 (0.31) KMT2AALDH1A1MEN1MAPT
SCHEMBL15944317 0.82 LMNA (0.36) KMT2APKMALDH1A1HPGDCYP1A2
SCHEMBL15944346 0.81 ALDH1A1 (0.41) KMT2APKMALDH1A1HPGDCYP1A2

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 KMT2A 466/4885PKM 2407/4885ALDH1A1 1329/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 KMT2A 1181/4885PKM 1010/4885ALDH1A1 215/4885

“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.