SCHEMBL5080481

SCHEMBL5080481

CC(C)=C(C(=O)O)c1ccccc1COc1cc(Cl)c(Oc2ccc([N+](=O)[O-])cc2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.42
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAOB P27338 5/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 2/20 0.39
PTPN7 P35236 1/20 0.39
PTPN12 Q05209 1/20 0.39
PTPN22 Q9Y2R2 1/20 0.39
MAOA P21397 2/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL5080482 0.93 OPRL1 (0.45) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL6151532 0.86 OPRL1 (0.42) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL6151528 0.84 OPRL1 (0.41) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL6151533 0.84 OPRL1 (0.41) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL6149902 0.84 HIF1A (0.46) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL6149906 0.84 HIF1A (0.46) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL5080371 0.83 MRGPRX4 (0.43) OPRL1MAOBMAOA
SCHEMBL5080344 0.83 MAOB (0.41) SMN1; SMN2MAOBMAOAPKMMAPK1
SCHEMBL5079550 0.83 OPRL1 (0.40) OPRL1MAPTSMN1; SMN2MAOBNPSR1
SCHEMBL5080480 0.80 ALDH1A1 (0.41) OPRL1MAPTSMN1; SMN2MAOBNPSR1

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 OPRL1 3733/4885MAPT 883/4885SMN1; SMN2 257/4885

“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.