SCHEMBL15944281

SCHEMBL15944281

C=CCOC(=O)OC1=C(c2c(CC)cc(C)cc2CC)C(=O)CC(CCSc2ccc(C)cc2)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15944278 0.92 ALDH1A1 (0.37) MAPTALDH1A1KDM4ENPSR1MEN1
SCHEMBL14235151 0.92 KMT2A (0.33) NPSR1MEN1KMT2A
SCHEMBL15944299 0.88
SCHEMBL15944274 0.88 ALDH1A1 (0.34) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL15944289 0.86 ALDH1A1 (0.35) MAPTALDH1A1KDM4ENPSR1MEN1
SCHEMBL15944272 0.85 ALDH1A1 (0.35) MAPTALDH1A1KDM4ENPSR1MEN1
SCHEMBL14235146 0.84 ALOX5 (0.33) MAPTALDH1A1
SCHEMBL15944276 0.83 ALDH1A1 (0.34) MAPTALDH1A1MEN1KMT2A
SCHEMBL14234823 0.82 ALDH1A1 (0.36) ALDH1A1
SCHEMBL14235148 0.80 APOB (0.32)

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 MAPT 4773/4885ALDH1A1 1329/4885KDM4E 214/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 MAPT 1013/4885ALDH1A1 215/4885KDM4E 3089/4885

“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.