SCHEMBL914341

SCHEMBL914341

O=c1ocnc2sc3c(c12)CCCCC3

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
KMT2A Q03164 4/20 0.54
HTT P42858 2/20 0.54
CHEK1 O14757 1/20 0.54
TSHR P16473 1/20 0.54
APP P05067 1/20 0.52
LIMK1 P53667 2/20 0.51
SMN1; SMN2 Q16637 5/20 0.51
MAPT P10636 4/20 0.51
RAB9A P51151 3/20 0.51
KDM4E B2RXH2 2/20 0.51
NPC1 O15118 2/20 0.51
HPGD P15428 4/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 3/20 0.49
CASP3 P42574 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ELANE P08246 3/20 0.49

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
SCHEMBL914683 0.98 KMT2A (0.55) GAAKMT2AHTTCHEK1TSHR
SCHEMBL914053 0.95 NPSR1 (0.55) GAAKMT2AHTTCHEK1TSHR
SCHEMBL914020 0.81 LIMK1 (0.51) GAAKMT2AHTTCHEK1TSHR
SCHEMBL913457 0.79 LIMK1 (0.50) GAAKMT2AHTTCHEK1TSHR
SCHEMBL914350 0.76 LIMK1 (0.50) GAAKMT2AHTTCHEK1TSHR
SCHEMBL923863 0.75 GAA (0.46) GAAKMT2AHTTCHEK1TSHR
SCHEMBL913993 0.73 GAA (0.57) GAAKMT2AHTTCHEK1TSHR
SCHEMBL913451 0.73 SMN1; SMN2 (0.45) GAAKMT2AHTTCHEK1TSHR
SCHEMBL914710 0.72 GAA (1.00) GAAKMT2AHTTCHEK1TSHR
SCHEMBL913458 0.71 HTT (0.56) GAAKMT2AHTTCHEK1TSHR

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-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US disclosed
EP-1631295-B1 USE OF CONDENSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN DISEASES AREXIS AB (SE) 2010-03-03 EP 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 GAA 1036/4885KMT2A 2584/4885HTT 3172/4885

“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.