SCHEMBL1610096

SCHEMBL1610096

COC(=O)c1nc(C2CC2)nc(NCC(F)c2cccc(Br)c2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.34
PDE10A Q9Y233 4/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33
SLC6A9 P48067 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ELANE P08246 1/20 0.32
KCNA5 P22460 2/20 0.32
SLC6A3 Q01959 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
CXCR5 P32302 1/20 0.31
APLNR P35414 1/20 0.31
CCR6 P51684 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL12713060 0.90 PDE10A (0.36) PDE10AALDH1A1SMN1; SMN2HSD17B10ELANE
SCHEMBL1610256 0.89 PDE10A (0.34) PDE10AALDH1A1SMN1; SMN2HSD17B10SLC6A3
SCHEMBL1610357 0.88 HCRTR1 (0.37) MAPTMEN1KMT2A
SCHEMBL1609656 0.85 PDE10A (0.34) PDE10AMAPTGAAALDH1A1SMN1; SMN2
SCHEMBL1610716 0.83 PDE10A (0.36) MAPK1PDE10AALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1610314 0.82 PDE10A (0.44) MAPK1PDE10AALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1609641 0.82 PDE10A (0.47) PDE10A
SCHEMBL1610436 0.80 PDE10A (0.42) MAPK1PDE10AALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1609438 0.80 PDE10A (0.42) MAPK1PDE10AALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1610368 0.80 HIF1A (0.40) PDE10AGAAALDH1A1SMN1; SMN2HSD17B10

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 3 patents. 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
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
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 MAPK1 1418/4885PDE10A 1704/4885MAPT 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.