SCHEMBL5238501

SCHEMBL5238501

O=C1CC(C(=O)c2ccccc2)CO1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.71
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
ALOX15 P16050 1/20 0.42
HBB P68871 1/20 0.42
MCL1 Q07820 1/20 0.41
EPHX1 P07099 1/20 0.41
SLC18A3 Q16572 2/20 0.40
HTR2A P28223 1/20 0.39
CPB1 P15086 1/20 0.39
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MGLL Q99685 1/20 0.38
HSD11B1 P28845 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL8535181 0.90 HTT (0.68) HTTMAPTKDM4ELMNAEPHX1
SCHEMBL7266828 0.83 HTT (0.71) HTTMAPTKDM4ELMNAMGLL
SCHEMBL8532319 0.80 HTT (0.68) HTTMAPTKDM4ELMNAHTR2A
SCHEMBL6560271 0.79 HTT (0.47) HTTMAPTKDM4ELMNAHSD17B10
SCHEMBL6561804 0.79 HTT (0.47) HTTMAPTKDM4ELMNAHSD17B10
SCHEMBL6383066 0.79 HTT (0.54) HTTMAPTKDM4ELMNA
SCHEMBL3226999 0.76 HTT (0.61) HTTMAPTKDM4ELMNAPOLB
SCHEMBL546967 0.74
SCHEMBL18641645 0.74
SCHEMBL7896960 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397364-B1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS LILLY CO ELI (US) 2007-07-25 EP disclosed
US-7087626-B2 Pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-08-08 US disclosed
US-20040106604-A1 Novel pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY 2004-06-03 US disclosed
EP-1397364-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2004-03-17 EP disclosed
WO-2002094833-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2002-11-28 WO disclosed
EP-0885869-A1 THERAPEUTIC AGENT FOR DIABETES Japan Tobacco Inc. (JP) 1998-12-23 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-20040106604-A1 Novel pyrrole derivatives as pharmaceutical agents TGFBR1, SMAD3, TGFBR2 HTT 4269/4885MAPT 1813/4885KDM4E 1699/4885

“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.