SCHEMBL4949049

SCHEMBL4949049

CCCCCCCCCCCCc1ccc(-c2ccc(-c3cccs3)cc2)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.44
LTA4H P09960 2/20 0.44
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
CYP17A1 P05093 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
GAPDH P04406 1/20 0.38
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.38
NR4A1 P22736 1/20 0.38
APEX1 P27695 1/20 0.38
PTPN7 P35236 1/20 0.38

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
SCHEMBL14089649 1.00 DPP4 (0.44) DPP4LTA4HLPLLIPGCYP17A1
SCHEMBL1333578 0.89 LTA4H (0.56) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL8571707 0.89 LTA4H (0.56) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL1756468 0.89 LTA4H (0.56) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL833843 0.89 LTA4H (0.56) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL11957366 0.88 PGR (0.40) DPP4LTA4HCYP17A1KDM4EALDH1A1
SCHEMBL2769963 0.88 DPP4 (0.57) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL14284941 0.88 DPP4 (0.57) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL2028518 0.88 DPP4 (0.57) DPP4LTA4HKDM4EALDH1A1GAA
SCHEMBL4280934 0.88 LTA4H (0.54) DPP4LTA4HKDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188670-A1 1,4-Dithienylbenzene Derivative NAT. INST. OF ADVANCED INDUSTRIAL SCI. AND TECH. (JP) 2008-08-07 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-20080188670-A1 1,4-Dithienylbenzene Derivative SLC22A4, SLC19A2, SLC22A1 DPP4 2060/4885LTA4H 1564/4885LPL 4253/4885

“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.