SCHEMBL9561573

SCHEMBL9561573

COCCCNC(=O)c1ccc(C(=O)NCCCOC)nc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
KDM4E B2RXH2 3/20 0.54
KMT2A Q03164 3/20 0.52
HPGD P15428 2/20 0.51
HPGDS O60760 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
GABRA5 P31644 1/20 0.49
MEN1 O00255 2/20 0.49
POLB P06746 1/20 0.49
TP53 P04637 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HTT P42858 1/20 0.48
KDM4C Q9H3R0 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL13116578 0.91 HPGD (0.57) ALDH1A1KDM4EKMT2AHPGDNPC1
SCHEMBL16109895 0.87 ALDH1A1 (0.67) ALDH1A1KDM4EKMT2AHPGDNPC1
SCHEMBL5422992 0.85 KDM4E (0.74) ALDH1A1KDM4EKMT2AHPGDNPC1
SCHEMBL9561214 0.84 ALDH1A1 (0.55) ALDH1A1KDM4EKMT2AHPGDHPGDS
SCHEMBL14959680 0.83 ALDH1A1 (0.53) ALDH1A1KDM4EKMT2AHPGDHPGDS
SCHEMBL8824851 0.82 L3MBTL1 (0.61) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL2428778 0.82 HCAR3 (0.63) ALDH1A1KDM4EHPGDTP53L3MBTL1
SCHEMBL16111493 0.82 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL7660982 0.81 POLB (0.56) ALDH1A1KDM4EKMT2AHPGDNPC1
SCHEMBL8869449 0.81 P4HTM (0.48) ALDH1A1KDM4EKMT2AHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5260323-A 2,4- and 2,5-substituted pyridine-N-oxides, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-09 US disclosed