SCHEMBL5076451

SCHEMBL5076451

COC(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 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
LIPE Q05469 6/20 0.41
KMT2A Q03164 1/20 0.41
MRGPRX4 Q96LA9 3/20 0.41
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRL1 P41146 1/20 0.40
MGLL Q99685 1/20 0.39
RPS6KA3 P51812 1/20 0.39
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 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
SCHEMBL5076449 0.93 LIPE (0.42) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL5080372 0.88 OPRL1 (0.44) MRGPRX4OPRL1
SCHEMBL6149563 0.85 LIPE (0.41) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL6151253 0.85 HIF1A (0.49) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL6151255 0.85 HIF1A (0.49) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL6149567 0.85 LIPE (0.41) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL5076419 0.83 MAPK1 (0.41) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL5076415 0.83 HIF1A (0.59) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL5076445 0.83 KDM4E (0.41) LMNALIPEKMT2AMRGPRX4TSHR
SCHEMBL5080322 0.82 HIF1A (0.49) LMNALIPEKMT2AMRGPRX4TSHR

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 LMNA 4661/4885LIPE 3682/4885KMT2A 3499/4885

“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.