SCHEMBL2115894

SCHEMBL2115894

CN(C)C(=O)Cc1nc(Cl)c(Cl)c(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
HSD17B10 Q99714 3/20 0.34
HTT P42858 1/20 0.34
NR4A2 P43354 2/20 0.34
NOTUM Q6P988 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 0.31
LMNA P02545 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB2 P47870 2/20 0.31
ALB P02768 1/20 0.31
CYP3A4 P08684 1/20 0.31
CHRM1 P11229 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA3 P34903 1/20 0.31
ADRA1A P35348 1/20 0.31
OPRK1 P41145 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
SCHEMBL2117961 0.72 GAA (0.40) GAAHSD17B10HTTNR4A2SMN1; SMN2
SCHEMBL2115243 0.67 HRH3 (0.32) ALDH1A1
SCHEMBL1483401 0.67 KDM4E (0.41) HSD17B10NR4A2SMN1; SMN2KDM4EHPGD
SCHEMBL27281626 0.66
SCHEMBL11526178 0.64 GAA (0.33) GAANR4A2
SCHEMBL11533740 0.63 GAA (0.32) GAANR4A2
SCHEMBL11028342 0.62 HTT (0.50) HTTSMN1; SMN2LMNACYP3A4KCNH2
SCHEMBL29894648 0.61 RAB9A (0.55) HTTLMNAALDH1A1NPC1RAB9A
SCHEMBL2117455 0.60 KMT2A (0.32)
SCHEMBL2116123 0.60

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-8158787-B2 Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-17 US disclosed
US-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2128141-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-12-02 EP 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-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND DPYD, TYMP, TST GAA 2959/4885HSD17B10 1580/4885HTT 1214/4885

“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.