SCHEMBL15944342

SCHEMBL15944342

Cc1ccc(SCCC2CC(=O)C(c3ccccc3F)=C(O)C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.35
MAPT P10636 6/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 5/20 0.34
HPGD P15428 4/20 0.34
CYP3A4 P08684 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 6/20 0.33
MEN1 O00255 4/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HKDC1 Q2TB90 1/20 0.32

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
SCHEMBL15944280 0.89 HPGD (0.39) PKMMAPTTP53ALDH1A1HPGD
SCHEMBL15945748 0.87 CCKAR (0.33) MAPTKMT2AMEN1NPSR1
SCHEMBL15944316 0.87 PKM (0.35) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944365 0.87 L3MBTL1 (0.41) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944325 0.86 PKM (0.34) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944464 0.85 LMNA (0.43) PKMMAPTPOLBALDH1A1HPGD
SCHEMBL15944343 0.84 KMT2A (0.33) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944317 0.84 LMNA (0.36) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944346 0.83 ALDH1A1 (0.41) PKMMAPTALDH1A1HPGDCYP3A4
SCHEMBL15944268 0.79 KMT2A (0.33) PKMMAPTTP53POLBALDH1A1

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 PKM 2407/4885MAPT 4773/4885TP53 4069/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 PKM 1010/4885MAPT 1013/4885TP53 3344/4885

“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.