SCHEMBL10238143

SCHEMBL10238143

CCc1sc(-c2ccc(Cl)c(C#N)c2)nc1C1C(=O)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 1/20 0.34
▸ GRM2 Q14416 2/20 0.32
▸ PDE4A P27815 2/20 0.31
▸ XDH P47989 2/20 0.30
▸ CTSC P53634 1/20 0.30
▸ ABCC4 O15439 1/20 0.30
▸ ABCB11 O95342 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ BLVRB P30043 1/20 0.30
▸ TARBP2 Q15633 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30
▸ ABCG2 Q9UNQ0 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL10238063 0.87 EIF4E (0.35) EIF4EGRM2PDE4AXDHCTSC
SCHEMBL10237940 0.86 PDE3B (0.34) GRM2KDM4EALDH1A1MAPTHPGD
SCHEMBL10237956 0.85 CYP11B1 (0.36) PDE4A
SCHEMBL10238126 0.83 HRH3 (0.35) —
SCHEMBL16215992 0.82 HRH3 (0.41) KDM4EALDH1A1MAPTHPGD
SCHEMBL608047 0.82 HRH3 (0.41) KDM4EALDH1A1MAPTHPGD
SCHEMBL10237937 0.82 HRH3 (0.41) KDM4EALDH1A1MAPTHPGD
SCHEMBL10237941 0.82 KDM4E (0.35) KDM4EALDH1A1
SCHEMBL10238124 0.79 SLC6A3 (0.39) ALDH1A1NPSR1TDP1L3MBTL1
SCHEMBL10238162 0.79 S1PR1 (0.44) —

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 EIF4E 4221/4885GRM2 68/4885PDE4A 948/4885

“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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