SCHEMBL14505487

SCHEMBL14505487

CCOC(=O)c1cc(-c2ccccc2)sc1NC1CCOCC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.62
HPGD P15428 8/20 0.62
LMNA P02545 1/20 0.62
KDM4E B2RXH2 4/20 0.60
TP53 P04637 1/20 0.60
THRB P10828 1/20 0.60
GSTO1 P78417 1/20 0.59
MAPT P10636 7/20 0.58
NPSR1 Q6W5P4 3/20 0.58
CNR2 P34972 1/20 0.56
GAA P10253 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALOX15 P16050 1/20 0.56
RAB9A P51151 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CHEK1 O14757 1/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
HTT P42858 1/20 0.53

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
SCHEMBL5432089 0.90 ALDH1A1 (0.66) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL5434339 0.90 ALDH1A1 (0.66) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL5444405 0.89 ALDH1A1 (0.65) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL14505518 0.84 HPGD (0.60) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL14505526 0.83 CHEK1 (0.53) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL14505523 0.80 ALDH1A1 (0.57) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL5435719 0.79 IKBKB (0.46) ALDH1A1HPGDKDM4EMAPTCNR2
SCHEMBL1579548 0.78 ALDH1A1 (0.72) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL14505521 0.78 ALDH1A1 (0.54) ALDH1A1HPGDLMNAKDM4ETP53
SCHEMBL5430057 0.77 CNR2 (0.55) ALDH1A1HPGDLMNAKDM4ETP53

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-20070099929-A1 Substituted thiophenes AICURIS GMBH & CO. KG (DE) 2007-05-03 US disclosed
US-20070099929-A1 Substituted thiophenes AICURIS GMBH & CO. KG (DE) 2007-05-03 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-20070099929-A1 Substituted thiophenes TPMT, HAVCR2, MTAP ALDH1A1 1246/4885HPGD 2665/4885LMNA 4343/4885

“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.