SCHEMBL5872455

SCHEMBL5872455

O=C(O)c1ccc(Sc2cccs2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.53
LIG1 P18858 1/20 0.53
DAO P14920 7/20 0.50
FBP1 P09467 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
HPGDS O60760 2/20 0.38
LMNA P02545 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 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
SCHEMBL2786198 0.85 LMNA (0.54) PKMLIG1DAOFBP1MEN1
SCHEMBL2785866 0.84 HPGDS (0.56) FBP1MEN1KMT2ARAB9APOLB
SCHEMBL7060968 0.77 PKM (0.58) PKMLIG1DAOMEN1KMT2A
SCHEMBL11392259 0.75 PKM (0.56) PKMLIG1DAOMEN1KMT2A
SCHEMBL11400595 0.75 PKM (0.56) PKMLIG1DAOMEN1KMT2A
SCHEMBL2786209 0.74 FBP1 (0.46) FBP1RAB9ACES2CES1
SCHEMBL2432241 0.74 FBP1 (0.68) DAOFBP1MEN1KMT2ARAB9A
SCHEMBL28419126 0.73 DAO (0.45) DAOFBP1MEN1KMT2ARAB9A
SCHEMBL19259788 0.72 HPGD (0.42) PKMMEN1KMT2ARAB9APOLB
SCHEMBL28644408 0.71 POLB (0.35) PKMFBP1MEN1KMT2ARAB9A

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-7084136-B2 Drug composition antagonistic to both PGD2/TXA2 receptors SHIONOGI & CO., LTD. (JP) 2006-08-01 US disclosed
US-20040024019-A1 Drug composition antagonistic to both pgd2/txa2 receptors SHIONOGI & CO. LTD. (JP) 2004-02-05 US disclosed
EP-1295872-A1 DRUG COMPOSITION ANTAGONISTIC TO BOTH PGD 2?/TXA 2? RECEPTORS SHIONOGI & CO., LTD. (JP) 2003-03-26 EP 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-20040024019-A1 Drug composition antagonistic to both pgd2/txa2 receptors PTGER1, PTGER2, TBXA2R PKM 3883/4885LIG1 2403/4885DAO 2366/4885

“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.