SCHEMBL913451

SCHEMBL913451

O=c1ncoc2sc3c(c12)CCCC3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.45
HSD17B10 Q99714 2/20 0.45
RAB9A P51151 2/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 4/20 0.44
CHEK1 O14757 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 1/20 0.43
LIMK1 P53667 3/20 0.43
NPSR1 Q6W5P4 1/20 0.41
APP P05067 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
DRD2 P14416 1/20 0.39
ALDH1A1 P00352 3/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 1/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39

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
SCHEMBL923863 0.98 GAA (0.46) SMN1; SMN2HSD17B10RAB9AALOX15HTT
SCHEMBL913911 0.97 NPSR1 (0.44) SMN1; SMN2HSD17B10RAB9AALOX15HTT
SCHEMBL914683 0.74 KMT2A (0.55) SMN1; SMN2HSD17B10RAB9AALOX15HTT
SCHEMBL914341 0.73 GAA (0.56) SMN1; SMN2HSD17B10RAB9AHTTCHEK1
SCHEMBL914053 0.71 NPSR1 (0.55) SMN1; SMN2RAB9AHTTCHEK1TSHR
SCHEMBL913457 0.68 LIMK1 (0.50) SMN1; SMN2HSD17B10RAB9AALOX15HTT
SCHEMBL18131026 0.67 SMN1; SMN2 (0.67) SMN1; SMN2HSD17B10RAB9AHTTTSHR
SCHEMBL914020 0.67 LIMK1 (0.51) SMN1; SMN2HSD17B10HTTCHEK1TSHR
SCHEMBL914350 0.65 LIMK1 (0.50) HSD17B10HTTCHEK1TSHRKMT2A
SCHEMBL913458 0.62 HTT (0.56) SMN1; SMN2HSD17B10RAB9AALOX15HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US disclosed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 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-20060258651-A1 Use of heterocyclic compounds as scce inhibitors RCE1, CTSE, SPINT2 SMN1; SMN2 3806/4885HSD17B10 279/4885RAB9A 3514/4885

“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.