SCHEMBL13041483

SCHEMBL13041483

CCc1sc(-c2ccc(Br)cc2)nc1C1C(=O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 3/20 0.37
▸ GLA P06280 3/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TP53 P04637 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ DHFR P00374 1/20 0.32
▸ TYMS P04818 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ DCK P27707 1/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ CA1 P00915 1/20 0.30

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
SCHEMBL13041546 0.88 DCK (0.42) PTGDR2TP53LMNATHRBMAPT
SCHEMBL2762937 0.88 HRH3 (0.41) PTGDR2LMNAALDH1A1KDM4EPOLB
SCHEMBL13986201 0.88 L3MBTL1 (0.33) PTGDR2GLAL3MBTL1DCK
SCHEMBL13041543 0.88 L3MBTL1 (0.44) PTGDR2GLAL3MBTL1ALDH1A1KDM4E
SCHEMBL13041530 0.86 DCK (0.32) PTGDR2GLAL3MBTL1DCK
SCHEMBL13078054 0.85 PTGDR2 (0.34) PTGDR2GLAL3MBTL1TP53LMNA
SCHEMBL13041549 0.85 NPC1 (0.41) ALDH1A1KDM4EMAPTGAANPC1
SCHEMBL13041515 0.84 ADAMTS5 (0.31) —
SCHEMBL13041406 0.84 NPC1 (0.36) KDM4EMAPTNPC1CA1CA2
SCHEMBL13041500 0.83 GLA (0.38) GLATP53TDP1POLBSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — 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-20100279868-A1 NOVEL HERBICIDES DDT, HPD, HSD17B1 PTGDR2 865/4885GLA 3973/4885L3MBTL1 3731/4885

“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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