SCHEMBL923863

SCHEMBL923863

O=c1ncoc2sc3c(c12)CCCCC3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.44
RAB9A P51151 4/20 0.44
LIMK1 P53667 3/20 0.44
HSD17B10 Q99714 3/20 0.44
ALOX15 P16050 2/20 0.44
KMT2A Q03164 3/20 0.43
HTT P42858 2/20 0.43
CHEK1 O14757 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 3/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
APP P05067 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
SCHEMBL913451 0.98 SMN1; SMN2 (0.45) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL913911 0.95 NPSR1 (0.44) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL914341 0.75 GAA (0.56) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL914683 0.73 KMT2A (0.55) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL914053 0.70 NPSR1 (0.55) GAASMN1; SMN2RAB9ALIMK1KMT2A
SCHEMBL914020 0.69 LIMK1 (0.51) GAASMN1; SMN2LIMK1HSD17B10KMT2A
SCHEMBL913457 0.67 LIMK1 (0.50) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL18131026 0.66 SMN1; SMN2 (0.67) SMN1; SMN2RAB9AHSD17B10KMT2AHTT
SCHEMBL913993 0.64 GAA (0.57) GAASMN1; SMN2RAB9ALIMK1HSD17B10
SCHEMBL914350 0.64 LIMK1 (0.50) GAALIMK1HSD17B10KMT2AHTT

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 4 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
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP disclosed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 WO 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 GAA 1036/4885SMN1; SMN2 3806/4885RAB9A 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.