SCHEMBL10237997

SCHEMBL10237997

Cc1nc(-c2ccc(Cl)cc2F)sc1C1C(=O)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 3/20 0.34
▸ BCHE P06276 2/20 0.34
▸ S1PR1 P21453 2/20 0.33
▸ ACHE P22303 2/20 0.33
▸ SLC6A3 Q01959 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ SHMT1 P34896 1/20 0.32
▸ SHMT2 P34897 1/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ KMO O15229 1/20 0.31
▸ MAP3K14 Q99558 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 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
SCHEMBL10237926 0.84 GRM2 (0.39) GRM2BCHEACHESLC6A3SHMT1
SCHEMBL10237969 0.81 SMN1; SMN2 (0.46) SLC6A3CYP3A4
SCHEMBL10237955 0.80 GRM2 (0.37) GRM2S1PR1ACHESLC6A3S1PR3
SCHEMBL10237998 0.76 SLC6A3 (0.39) SLC6A3MAP3K14
SCHEMBL10237929 0.73 ACHE (0.39) GRM2ACHESLC6A3SHMT1SHMT2
SCHEMBL10237900 0.73 SHMT1 (0.41) ACHESLC6A3SHMT1SHMT2DPP4
SCHEMBL10238057 0.73 DPP4 (0.39) GRM2S1PR1S1PR3CYP11B1CYP11B2
SCHEMBL10237905 0.72 ACHE (0.37) ACHESHMT1SHMT2
SCHEMBL10237972 0.71 MAPT (0.33) —
SCHEMBL10238062 0.70 ACHE (0.39) ACHESLC6A3SHMT1SHMT2DPP4

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
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 — — 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-20120040826-A1 NOVEL HERBICIDES DDT, HDHD5, DDC GRM2 68/4885BCHE 34/4885S1PR1 4486/4885

“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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