SCHEMBL9348372

SCHEMBL9348372

O=c1c(CCCCCO)c(O)c2cccnc2n1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.49
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 1/20 0.47
GLA P06280 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
PDE4A P27815 7/20 0.46
PDE4B Q07343 6/20 0.46
PDE4C Q08493 6/20 0.46
PDE4D Q08499 6/20 0.46
TSHR P16473 2/20 0.45
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
LDHA P00338 1/20 0.40
LOXL3 P58215 1/20 0.40

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
SCHEMBL9348282 0.99 FEN1 (0.50) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9352330 0.95 FEN1 (0.51) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9351767 0.92 FEN1 (0.54) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9352380 0.90 ALDH1A1 (0.46) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9348174 0.89 MAPT (0.44) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9349392 0.88 FEN1 (0.49) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL11210390 0.87 ALDH1A1 (0.55) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL10814770 0.87 ALDH1A1 (0.55) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9767592 0.87 ALDH1A1 (0.57) FEN1ALDH1A1KDM4ECYP2C19CYP1A2
SCHEMBL9348283 0.87 MAPT (0.46) FEN1ALDH1A1KDM4ECYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5350755-A Treatment of psoriasis or eczema with naphthyridine derivative SCHERING CORPORATION (US) 1994-09-27 US disclosed
US-4775524-A PSORIASIS SCHERING CORPORATION (US) 1988-10-04 US disclosed
US-4652564-A Substituted spiro pyridine derivatives as anti-allergy and antiinflammatory agents SCHERING CORPORATION (US) 1987-03-24 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