SCHEMBL1610083

SCHEMBL1610083

COC(=O)c1nc(C2CC2)nc(N(C)c2cnc(Cl)s2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.35
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.30
PKM P14618 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
RECQL P46063 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
SCHEMBL1610082 0.81 ERCC1 (0.34) PDE10AALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL1610086 0.80 PDE10A (0.34) PDE10AKMT2A
SCHEMBL719721 0.79 PDE10A (0.41) PDE10AALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL1610401 0.79 PDE10A (0.31) PDE10A
SCHEMBL1609145 0.78 TUBB4A (0.43) ALDH1A1SMN1; SMN2POLBKDM4EPKM
SCHEMBL1609691 0.77 SLC6A3 (0.42) ALDH1A1SMN1; SMN2LMNAPOLBKDM4E
SCHEMBL1609767 0.77 TUBB4A (0.42) ALDH1A1KMT2ASMN1; SMN2LMNAKDM4E
SCHEMBL1609757 0.77 TUBB4A (0.40) PDE10AALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL1609450 0.77 TUBB4A (0.42) PDE10AALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL1610745 0.77 TRPM8 (0.35) ALDH1A1SMN1; SMN2LMNAPOLBKDM4E

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 1704/4885ALDH1A1 1562/4885KMT2A 2003/4885

“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.