SCHEMBL9628874

SCHEMBL9628874

O=C1c2cccnc2N(c2ccccc2)C(=O)C12CCO2

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.36
ALDH1A1 P00352 3/20 0.35
PGR P06401 1/20 0.33
GAA P10253 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
HIF1A Q16665 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MARK3 P27448 1/20 0.32
PKM P14618 1/20 0.32
TLR9 Q9NR96 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9629835 0.94 EGLN1 (0.34) EGLN1ALDH1A1PGRGAAKDM4E
SCHEMBL9629039 0.93 EGLN1 (0.34) EGLN1ALDH1A1PGRGAAKDM4E
SCHEMBL9537511 0.83 PGR (0.41) ALDH1A1PGRGAAMEN1KMT2A
SCHEMBL9629185 0.81 PGR (0.36) ALDH1A1PGRKDM4EL3MBTL1SMN1; SMN2
SCHEMBL9348254 0.79 PGR (0.43) EGLN1ALDH1A1PGRHTTHIF1A
SCHEMBL9628950 0.79 MAPT (0.38) ALDH1A1GAAKDM4EL3MBTL1MEN1
SCHEMBL9767621 0.68 ELANE (0.46) EGLN1ALDH1A1PGRKDM4EHTT
SCHEMBL9348228 0.68 PGR (0.55) EGLN1PGRMEN1KMT2A
SCHEMBL9348253 0.68 POLB (0.44) EGLN1ALDH1A1PGRGAAMEN1
SCHEMBL15217706 0.68 GAA (0.47) ALDH1A1GAAKDM4EHTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0338010-B1 PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OF HYPERPROLIFERATE SKIN DISEASE SCHERING CORPORATION (US) 1992-02-05 EP claimed
EP-0144996-B1 SUBSTITUTED SPIRO PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THE PREPARATION OF SUCH COMPOUNDS AND COMPOSITIONS SCHERING CORPORATION (US) 1990-02-28 EP claimed
EP-0228416-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING AZANAPHTHALENES. SCHERING CORP (US) 1987-07-15 EP claimed
WO-1986007537-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING AZANAPHTHALENES SCHERING CORPORATION (US) 1986-12-31 WO claimed
EP-0144996-A2 Substituted spiro pyridine derivatives, pharmaceutical compositions containing them and processes for the preparation of such compounds and compositions SCHERING CORPORATION (US) 1985-06-19 EP claimed
EP-0144996-B1 SUBSTITUTED SPIRO PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THE PREPARATION OF SUCH COMPOUNDS AND COMPOSITIONS SCHERING CORPORATION (US) 1990-02-28 EP disclosed
US-4775524-A PSORIASIS SCHERING CORPORATION (US) 1988-10-04 US disclosed
US-4632923-A Substituted hetero spiro pyridine derivatives as anti-allergy and anti-inflammatory agents SCHERING CORPORATION (US) 1986-12-30 US disclosed
EP-0144996-A2 Substituted spiro pyridine derivatives, pharmaceutical compositions containing them and processes for the preparation of such compounds and compositions SCHERING CORPORATION (US) 1985-06-19 EP disclosed