SCHEMBL5076449

SCHEMBL5076449

CC(C)=C(C(=O)O)c1ccccc1COc1cc(Cl)c(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 6/20 0.42
KMT2A Q03164 1/20 0.42
MRGPRX4 Q96LA9 3/20 0.40
MGLL Q99685 1/20 0.40
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
GAA P10253 1/20 0.38

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
SCHEMBL5076451 0.93 LMNA (0.42) LIPEKMT2AMRGPRX4MGLLMAPK1
SCHEMBL5080371 0.88 MRGPRX4 (0.43) MRGPRX4
SCHEMBL6151255 0.85 HIF1A (0.49) LIPEKMT2AMRGPRX4MAPK1TSHR
SCHEMBL6151253 0.85 HIF1A (0.49) LIPEKMT2AMRGPRX4MAPK1TSHR
SCHEMBL6149567 0.85 LIPE (0.41) LIPEKMT2AMRGPRX4MGLLMAPK1
SCHEMBL6149563 0.85 LIPE (0.41) LIPEKMT2AMRGPRX4MGLLMAPK1
SCHEMBL5076419 0.84 MAPK1 (0.41) LIPEKMT2AMRGPRX4MGLLMAPK1
SCHEMBL5076445 0.81 KDM4E (0.41) LIPEKMT2AMRGPRX4TSHRSMN1; SMN2
SCHEMBL5076415 0.81 HIF1A (0.59) LIPEKMT2AMRGPRX4TSHRSMN1; SMN2
SCHEMBL5080372 0.81 OPRL1 (0.44) MRGPRX4

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-7435844-B2 Analogous compounds of strobilurines and their use as acaricides and insecticides ISAGRO RICERCA S.R.L. (IT) 2008-10-14 US disclosed
US-20060235075-A1 Analogous compounds of strobilurines and their use as acaricides and insecticides ISAGRO RICERCA S.R.L. (IT) 2006-10-19 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-20060235075-A1 Analogous compounds of strobilurines and their use as acaricides and insecticides DDT, RYR1, TPMT LIPE 3682/4885KMT2A 3499/4885MRGPRX4 989/4885

“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.