SCHEMBL16961336

SCHEMBL16961336

CCCCOc1c[c]cc(C(N)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.47
▸ PARP10 Q53GL7 2/20 0.45
▸ RAB9A P51151 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SAE1 Q9UBE0 1/20 0.43
▸ UBA2 Q9UBT2 1/20 0.43
▸ PLA2G4B P0C869 2/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ ACR P10323 1/20 0.42

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
SCHEMBL17046380 0.92 KMT2A (0.47) PLA2G2APARP10TSHRSMN1; SMN2
SCHEMBL21268367 0.85 PLA2G2A (0.61) PLA2G2ATP53TSHRPLA2G4B
SCHEMBL16958804 0.85 PARP10 (0.58) PARP10TSHRNPC1PRSS1
SCHEMBL15977059 0.83 PLA2G2A (0.57) PLA2G2APARP10RAB9AGAATP53
SCHEMBL17414620 0.83 PLA2G2A (0.62) PLA2G2APARP10RAB9AGAATP53
SCHEMBL17046327 0.83 MAPT (0.51) PLA2G2ARAB9ATP53TSHRNPC1
SCHEMBL21268294 0.82 PARP10 (0.40) PLA2G2APARP10TSHRPRSS1
SCHEMBL2230790 0.78 LTA4H (0.47) PLA2G2ARAB9AGAATP53TSHR
SCHEMBL1569898 0.78 ALDH1A1 (0.40) PARP10RAB9ATSHR
SCHEMBL1086686 0.78 PARP10 (0.72) PARP10RAB9AGAATP53TSHR

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 4 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
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP 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 PLA2G2A 3238/4885PARP10 3838/4885RAB9A 4465/4885

“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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