SCHEMBL10238133

SCHEMBL10238133

CCc1sc(-c2ccc(F)cc2F)nc1C1C(=O)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.39
▸ GRM2 Q14416 15/20 0.35
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ ACKR3 P25106 2/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ S1PR3 Q99500 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
SCHEMBL10237955 0.89 GRM2 (0.37) GRM2CYP11B1CYP11B2S1PR1S1PR3
SCHEMBL10237973 0.89 GLA (0.30) DPP4
SCHEMBL10238057 0.85 DPP4 (0.39) DPP4GRM2CYP11B1CYP11B2ACKR3
SCHEMBL10238117 0.84 DCK (0.42) DPP4
SCHEMBL10238130 0.82 ILK (0.35) —
SCHEMBL10238010 0.82 CRHR1 (0.32) —
SCHEMBL10237996 0.80 KDM4E (0.40) DPP4
SCHEMBL10237961 0.80 — —
SCHEMBL10237982 0.80 GLA (0.36) —
SCHEMBL10237956 0.79 CYP11B1 (0.36) CYP11B1CYP11B2

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-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
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 DPP4 9/4885GRM2 68/4885CYP11B1 1537/4885

“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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