SCHEMBL17046253

SCHEMBL17046253

CCOc1c[c]cc(C(=O)OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 3/20 0.41
▸ PLK1 P53350 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ RAB9A P51151 4/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ PARP10 Q53GL7 1/20 0.40
▸ LOXL2 Q9Y4K0 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ XDH P47989 1/20 0.39
▸ GFER P55789 1/20 0.39

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
SCHEMBL17046334 0.87 MAPT (0.49) MAPTKDM4EPLK1ALDH1A1RAB9A
SCHEMBL17046327 0.85 MAPT (0.51) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4284172 0.84 CA1 (0.52) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4316367 0.82 PLA2G4B (0.49) MAPTRAB9ANPC1PARP10POLB
SCHEMBL21268388 0.82 MAPT (0.47) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL17046354 0.82 XDH (0.46) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL3176817 0.82 KDM4E (0.54) MAPTKDM4EPLK1ALDH1A1RAB9A
SCHEMBL11171580 0.82 KDM4E (0.50) MAPTKDM4EPLK1ALDH1A1RAB9A
SCHEMBL1570516 0.81 PLK1 (0.60) MAPTPLK1ALDH1A1RAB9ANPC1
SCHEMBL300172 0.81 CA1 (0.52) MAPTKDM4EALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-B1 HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-08-21 — — EP disclosed
US-9585392-B2 3-phenylisoxazolin derivatives with herbicidal action BAYER CROPSCIENCE AG (DE) 2017-03-07 — — US disclosed
US-20150245615-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2015-09-03 — — 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-20150245615-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION CYP4X1, CBR3, PAOX MAPT 4724/4885KDM4E 2719/4885PLK1 3935/4885

“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.

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