SCHEMBL4696972

SCHEMBL4696972

COC(=O)c1ncccc1-c1ccc(C=O)c(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 13/20 0.50
L3MBTL1 Q9Y468 1/20 0.43
METAP2 P50579 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.39

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
SCHEMBL4697928 0.85 ERN1 (0.45) ERN1L3MBTL1METAP2ALOX15HTT
SCHEMBL31325771 0.80 L3MBTL1 (0.45) L3MBTL1METAP2ALDH1A1ALOX15HTT
SCHEMBL31325753 0.80 L3MBTL1 (0.45) L3MBTL1METAP2ALDH1A1HTTLMNA
SCHEMBL4700610 0.79 L3MBTL1 (0.49) L3MBTL1METAP2ALDH1A1ALOX15HTT
SCHEMBL31325694 0.77 ALDH1A1 (0.52) L3MBTL1ALDH1A1HTTLMNA
SCHEMBL9964039 0.76 DYRK1A (0.53) L3MBTL1ALDH1A1HTTLMNA
SCHEMBL2561503 0.75 L3MBTL1 (0.57) ERN1L3MBTL1ALDH1A1ALOX15HTT
SCHEMBL11617702 0.75 KMT2A (0.48) L3MBTL1ALDH1A1HTT
SCHEMBL69177 0.75 L3MBTL1 (0.64) L3MBTL1ALDH1A1ALOX15HTT
SCHEMBL25307003 0.74 L3MBTL1 (0.53) L3MBTL1ALDH1A1

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-20080312209-A1 Piperazine Heteroaryl Derivatives as Gpr38 Agonists GLAXO GROUP LIMITED 2008-12-18 US disclosed
EP-1902022-A1 PIPERAZINE HETEROARYL DERIVATES AS GPR38 AGONISTS GLAXO GROUP LIMITED (GB) 2008-03-26 EP disclosed
WO-2007007018-A1 PIPERAZINE HETEROARYL DERIVATES AS GPR38 AGONISTS GLAXO GROUP LIMITED (GB) 2007-01-18 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-20080312209-A1 Piperazine Heteroaryl Derivatives as Gpr38 Agonists GPR68, GPR55, GPR88 ERN1 4396/4885L3MBTL1 4125/4885METAP2 3925/4885

“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.