SCHEMBL6744761

SCHEMBL6744761

CO/C=C(/C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2NC(=O)S)ncn1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
MAPK8 P45983 1/20 0.35
MAPK10 P53779 1/20 0.35
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MTNR1B P49286 1/20 0.33
PYGL P06737 1/20 0.33
PYGM P11217 1/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
METAP2 P50579 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
SCHEMBL10431041 1.00 RAB9A (0.36) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL248231 0.90 MEN1 (0.36) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL16561719 0.89 MEN1 (0.41) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL6748555 0.87 TSHR (0.40) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL29361759 0.85 MEN1 (0.37) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL28928885 0.85 MEN1 (0.37) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL9121820 0.85 HTT (0.44) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL9121807 0.85 HTT (0.44) RAB9AKMT2AMEN1MAPK8MAPK10
SCHEMBL203515 0.84 MAPK8 (0.39) KMT2AMEN1MAPK8LMNASMN1; SMN2
SCHEMBL9125875 0.84 KMT2A (0.38) RAB9AKMT2AMEN1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382375-B1 Fungicides ZENECA LTD (GB) 1994-03-23 EP claimed
US-6780947-B1 CHARACTERIZED IN THAT SAID LIGAND CONSISTS OF A MONO-IMINE OF 2,6-DIACYLPYRIDINE ENICHEM S.P.A. (IT) 2004-08-24 US disclosed
US-20040092746-A1 Pyrimidinyloxyphenyl-3-alkoxypropenoate derivatives as pesticides CLOUGH JOHN MARTIN (GB) 2004-05-13 US disclosed
US-6613773-B2 Pyrimidinyloxyphenyl-3-alkoxypropenoates derivatives SYNGENTA LIMITED (GB) 2003-09-02 US disclosed
US-20030060626-A1 Fungicides SYNGENTA LIMITED (GB) 2003-03-27 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-20040092746-A1 Pyrimidinyloxyphenyl-3-alkoxypropenoate derivatives as pesticides DDT, SQOR, TH RAB9A 2457/4885KMT2A 491/4885MEN1 2186/4885
US-20030060626-A1 Fungicides CYP51A1, CYP1A1, CYP1A2 RAB9A 2224/4885KMT2A 352/4885MEN1 686/4885

“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.