SCHEMBL1209200

SCHEMBL1209200

N#Cc1c(NC(=O)C=Cc2ccoc2)sc2c1CCC(OC(=O)NCc1ccccn1)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
MAPT P10636 5/20 0.41
KDM4E B2RXH2 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
POLB P06746 3/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
LMNA P02545 1/20 0.41
NR0B1 P51843 1/20 0.41
TGFBR1 P36897 1/20 0.41
PTPN5 P54829 1/20 0.40
HTT P42858 2/20 0.39
HSD17B10 Q99714 1/20 0.37
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
UBA2 Q9UBT2 1/20 0.37

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
SCHEMBL1208910 0.90 PTPN5 (0.44) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1209638 0.90 PTPN5 (0.45) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1208124 0.89 TGFBR1 (0.42) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1209082 0.88 TGFBR1 (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL12882602 0.88 TGFBR1 (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1210191 0.88 TGFBR1 (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1206942 0.88 TGFBR1 (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1207840 0.88 ALDH1A1 (0.57) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1208213 0.88 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL1207821 0.87 PTPN5 (0.40) ALDH1A1MAPTKDM4ESMN1; SMN2POLB

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-20110044938-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES NYCOMED GMBH (DE) 2011-02-24 US disclosed
EP-2051974-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES 4SC AG (DE) 2009-04-29 EP disclosed
WO-2008020045-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES 4SC AG (DE) 2008-02-21 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-20110044938-A1 TETRAHYDROBENZOTHIOPHENE DERIVATIVES BAX, BCL2, BAD ALDH1A1 316/4885MAPT 865/4885KDM4E 2054/4885

“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.