SCHEMBL1207760

SCHEMBL1207760

N#Cc1c(NC(=O)CCc2ccccc2)sc2c1CCC(O)C2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.54
RAB9A P51151 2/20 0.52
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
NPC1 O15118 1/20 0.52
MAPT P10636 6/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
GAA P10253 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 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
SCHEMBL1207607 0.89 MAPT (0.49) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL1208011 0.88 PTPN5 (0.51) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL1209684 0.86 ALDH1A1 (0.58) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL1207312 0.85 MAPT (0.48) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL1208852 0.84 ALDH1A1 (0.55) RAB9APOLBSMN1; SMN2ALDH1A1NPC1
SCHEMBL2648446 0.84 MAPT (0.71) GCGRPOLBSMN1; SMN2ALDH1A1MAPT
SCHEMBL1209796 0.84 MAPT (0.53) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL1207647 0.82 MAPT (0.53) GCGRRAB9APOLBALDH1A1L3MBTL1
SCHEMBL1207750 0.81 ALDH1A1 (0.54) GCGRRAB9APOLBSMN1; SMN2ALDH1A1
SCHEMBL2893846 0.80 RAB9A (0.53) RAB9APOLBSMN1; SMN2ALDH1A1L3MBTL1

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 GCGR 4679/4885RAB9A 2531/4885POLB 1250/4885

“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.