SCHEMBL4739136

SCHEMBL4739136

O=c1cc(O)nc(C2CCCCCC2)n1C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.44
MAPT P10636 5/20 0.43
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
ALDH1A1 P00352 6/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.40
LMNA P02545 1/20 0.40
XBP1 P17861 1/20 0.40
CRHBP P24387 1/20 0.40
MAPK1 P28482 1/20 0.40
CRHR2 Q13324 1/20 0.40
USP2 O75604 2/20 0.39
POLB P06746 2/20 0.39
HCRTR1 O43613 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 2/20 0.37
KDM4E B2RXH2 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
SCHEMBL4738618 1.00 GAA (0.44) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL4742636 0.81 GAA (0.48) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL4737525 0.78 KMT2A (0.54) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL4739975 0.78 KMT2A (0.38) GAAMEN1KMT2AALDH1A1USP2
SCHEMBL4786165 0.78 APLNR (0.52) MAPTMEN1KMT2AALDH1A1USP2
SCHEMBL4739177 0.77 MAPT (0.49) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL4739974 0.77 ALDH1A1 (0.38) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4741076 0.76 KMT2A (0.42) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4739124 0.76 HPGD (0.43) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL28022171 0.75 MEN1 (0.41) GAAMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008089051-A1 N-SUBSTITUTED GLYCINE DERIVATIVES: PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-24 WO disclosed
US-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-07-17 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-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 GAA 172/4885MAPT 4781/4885MEN1 2935/4885

“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.