SCHEMBL10084285

SCHEMBL10084285

CC(C)c1csc(NC(=O)Cc2ccccc2)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELOVL1 Q9BW60 1/20 0.64
PRKACA P17612 1/20 0.60
ROCK1 Q13464 1/20 0.60
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
CCNT1 O60563 1/20 0.57
ALDH1A1 P00352 1/20 0.57
CDK1 P06493 1/20 0.57
CDK4 P11802 1/20 0.57
CCNB1 P14635 1/20 0.57
CCNA2 P20248 1/20 0.57
CCND1 P24385 1/20 0.57
CCNE1 P24864 1/20 0.57
CDK2 P24941 1/20 0.57
CDK7 P50613 1/20 0.57
CDK9 P50750 1/20 0.57
CCNH P51946 1/20 0.57
MNAT1 P51948 1/20 0.57

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
SCHEMBL28268613 0.82 RAB9A (0.75) ELOVL1PRKACAROCK1KMT2AMEN1
SCHEMBL92487 0.80 ELOVL1 (0.65) ELOVL1PRKACAROCK1KMT2AMEN1
SCHEMBL5726871 0.79 GLS (0.54) ELOVL1ROCK1KMT2AMEN1LMNA
SCHEMBL77834 0.78 KMT2A (0.77) ELOVL1PRKACAROCK1KMT2AMEN1
SCHEMBL19380614 0.78 ELOVL1 (1.00) ELOVL1PRKACAROCK1KMT2AMEN1
SCHEMBL9555938 0.78 ELOVL1 (0.53) ELOVL1PRKACAROCK1KMT2AMEN1
SCHEMBL26501704 0.77 RAB9A (0.45) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL29355425 0.77 RAB9A (0.51) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL5480586 0.77 CCNE1 (0.79) ELOVL1KMT2AMEN1CCNT1ALDH1A1
SCHEMBL9834404 0.77 ELOVL1 (0.65) ELOVL1PRKACAROCK1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119645-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-11-26 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-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 ELOVL1 3631/4885PRKACA 1047/4885ROCK1 2738/4885

“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.