SCHEMBL10238093

SCHEMBL10238093

Cc1sc(-c2ccc(OC(F)F)cc2Cl)nc1C1C(=O)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 6/20 0.35
▸ P2RX7 Q99572 1/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31

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
SCHEMBL10238109 0.89 P2RX7 (0.34) CRHR1P2RX7PDE2A
SCHEMBL13058549 0.86 CRHR1 (0.34) CRHR1DPP4
SCHEMBL10237989 0.83 ALDH1A1 (0.38) PDE2AMAPT
SCHEMBL10237900 0.83 SHMT1 (0.41) DPP4KDM4EMAPTSLC6A3
SCHEMBL13041534 0.80 CRHR1 (0.35) CRHR1P2RX7DPP4KDM4EMAPT
SCHEMBL10238058 0.79 ALDH1A1 (0.37) KDM4EMAPT
SCHEMBL13078056 0.77 CRHR1 (0.33) CRHR1
SCHEMBL10237926 0.77 GRM2 (0.39) SLC6A3
SCHEMBL10237929 0.77 ACHE (0.39) SLC6A3
SCHEMBL10238062 0.77 ACHE (0.39) DPP4KDM4EMAPTSLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176222-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-11-05 — — EP disclosed
US-8541594-B2 — — 2013-09-24 — — US disclosed
US-8541594-B2 — — 2013-09-24 — — US disclosed
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 — — US disclosed
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 — — US disclosed
WO-2009015877-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2009-02-05 — — WO 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-20120040826-A1 NOVEL HERBICIDES DDT, HDHD5, DDC CRHR1 2983/4885P2RX7 1433/4885PDE2A 2000/4885

“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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