SCHEMBL10238062

SCHEMBL10238062

Cc1sc(-c2cc(Cl)ccc2Cl)nc1C1C(=O)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.39
▸ AGPAT2 O15120 2/20 0.36
▸ HTR2B P41595 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ SHMT1 P34896 1/20 0.33
▸ SHMT2 P34897 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ EGFR P00533 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ POLB P06746 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
SCHEMBL10237900 0.91 SHMT1 (0.41) ACHESLC6A3DPP4SHMT1SHMT2
SCHEMBL10237929 0.88 ACHE (0.39) ACHEPDE4DSLC6A3TP53SHMT1
SCHEMBL10237926 0.86 GRM2 (0.39) ACHEPDE4DSLC6A3TP53SHMT1
SCHEMBL10238058 0.86 ALDH1A1 (0.37) ACHEPDE4DTP53EGFRKDM4E
SCHEMBL10238141 0.85 ACHE (0.35) ACHEAGPAT2HTR2BPDE4DSLC6A3
SCHEMBL10237905 0.84 ACHE (0.37) ACHESHMT1SHMT2
SCHEMBL10237934 0.83 RAB9A (0.40) ACHESLC6A3KDM4EMAPTPOLB
SCHEMBL10237915 0.82 SLC6A3 (0.39) ACHEPDE4DSLC6A3KDM4EMAPT
SCHEMBL16215997 0.82 SLC6A3 (0.39) ACHEPDE4DSLC6A3KDM4EMAPT
SCHEMBL10238030 0.81 HTR2C (0.44) ACHESLC6A3

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
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 ACHE 120/4885AGPAT2 1093/4885HTR2B 1113/4885

“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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