SCHEMBL12737587

SCHEMBL12737587

CC(Nc1nc(C2CC2)nc(C=O)c1Cl)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 3/20 0.50
▸ IDH1 O75874 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ PRCP P42785 1/20 0.35
▸ GALR3 O60755 1/20 0.35
▸ NR2F2 P24468 1/20 0.35
▸ CCNE2 O96020 3/20 0.35
▸ CCNE1 P24864 3/20 0.35
▸ CDK2 P24941 3/20 0.35
▸ CDK4 P11802 2/20 0.35

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
SCHEMBL12738438 0.88 PDE10A (0.38) PDE10AKMT2AMEN1LMNAIGF1R
SCHEMBL11918081 0.83 PDE10A (0.34) PDE10ACDK2
SCHEMBL1610170 0.78 PDE10A (0.50) PDE10AIDH1MAPTRECQLKDM4E
SCHEMBL12738185 0.72 PDE2A (0.35) PDE10AMAPTKDM4EALDH1A1HPGD
SCHEMBL12738147 0.71 PDE10A (0.47) PDE10A
SCHEMBL12738421 0.70 PDE10A (0.52) PDE10A
SCHEMBL12738487 0.69 CTSL (0.45) MAPTKMT2AMEN1
SCHEMBL1609803 0.69 PDE10A (0.50) PDE10AIDH1KDM4EGAAPRCP
SCHEMBL12738422 0.69 PDE10A (0.55) PDE10AKMT2A
SCHEMBL11918040 0.68 PDE10A (0.41) PDE10AHSD17B10ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 — — 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 PDE10A 1704/4885IDH1 209/4885MAPT 2800/4885

“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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