SCHEMBL937896

SCHEMBL937896

CCOC(=O)c1cc(-c2ccccc2)sc1Br

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.71
HPGD P15428 9/20 0.71
MAPT P10636 9/20 0.71
RAB9A P51151 4/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
GAA P10253 4/20 0.71
HSD17B10 Q99714 3/20 0.71
ALOX15 P16050 2/20 0.71
LMNA P02545 3/20 0.63
KDM4E B2RXH2 5/20 0.60
TP53 P04637 1/20 0.60
THRB P10828 1/20 0.60
GSTO1 P78417 1/20 0.59
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
NPC1 O15118 3/20 0.59
NPSR1 Q6W5P4 2/20 0.58
CNR2 P34972 1/20 0.56
CYP1A2 P05177 3/20 0.55
CYP2C9 P11712 3/20 0.55

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
SCHEMBL976420 0.84 ALDH1A1 (0.72) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL12987082 0.84 ALDH1A1 (0.68) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL654015 0.83 ALDH1A1 (1.00) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL937185 0.83 ALDH1A1 (0.71) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL14882798 0.82 ALDH1A1 (0.69) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL12085237 0.81 ALDH1A1 (0.67) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL1579548 0.79 ALDH1A1 (0.72) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL939706 0.78 GAA (0.64) ALDH1A1HPGDMAPTRAB9AGAA
SCHEMBL10707773 0.78 ALDH1A1 (0.67) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL5440410 0.78 HPGD (0.74) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2283004-B1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE UNIV EDINBURGH (GB) 2015-05-27 EP disclosed
EP-2283004-B1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE UNIV EDINBURGH (GB) 2015-05-27 EP disclosed
US-8614209-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2013-12-24 US disclosed
US-20130012545-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2013-01-10 US disclosed
US-20130012545-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2013-01-10 US disclosed
US-20130012545-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2013-01-10 US disclosed
US-8299063-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2012-10-30 US disclosed
US-8299063-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2012-10-30 US disclosed
US-8299063-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2012-10-30 US disclosed
EP-2283004-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE THE UNIVERSITY OF EDINBURGH (GB) 2011-02-16 EP disclosed
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US disclosed
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US disclosed
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US disclosed
WO-2009112845-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE THE UNIVERSITY OF EDINBURGH (GB) 2009-09-17 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 (2 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-20110015178-A1 Amido-Thiophene Compounds and Their Use HSD11B1, HSD11B2, HSD17B1 ALDH1A1 328/4885HPGD 215/4885MAPT 526/4885
US-20130012545-A1 Amido-Thiophene Compounds and Their Use HSD11B1, HSD11B2, HSD17B1 ALDH1A1 328/4885HPGD 215/4885MAPT 526/4885

“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.