SCHEMBL2635920

SCHEMBL2635920

O=C(O)c1ccccc1/N=C/c1cccnc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.55
▸ KDM4E B2RXH2 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ MAPT P10636 2/20 0.55
▸ LMNA P02545 2/20 0.55
▸ KMT2A Q03164 5/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ GAA P10253 3/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ CYP11B1 P15538 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ AKR1C3 P42330 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL2635921 1.00 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDMAPTLMNA
N-Benzylideneanthranilic Acid SCHEMBL19924599 0.84 ALDH1A1 (0.74) ALDH1A1KDM4EHPGDMAPTLMNA
N-Benzylideneanthranilic Acid SCHEMBL11423120 0.84 ALDH1A1 (0.74) ALDH1A1KDM4EHPGDMAPTLMNA
N-Benzylideneanthranilic Acid SCHEMBL11423123 0.84 ALDH1A1 (0.74) ALDH1A1KDM4EHPGDMAPTLMNA
SCHEMBL2636266 0.83 HPGD (0.59) ALDH1A1KDM4EHPGDMAPTLMNA
SCHEMBL11751639 0.83 HPGD (0.59) ALDH1A1KDM4EHPGDMAPTLMNA
SCHEMBL2636268 0.83 HPGD (0.59) ALDH1A1KDM4EHPGDMAPTLMNA
SCHEMBL2635941 0.77 KMT2A (0.48) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL2635938 0.77 KMT2A (0.48) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL11403858 0.75 KDM4E (0.61) ALDH1A1KDM4EHPGDMAPTLMNA

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
WO-2011140599-A1 CHEMICAL COMPOUND ARRAYS USEFUL FOR DETECTING BACTERIAL PEPTIDES MONASH UNIVERSITY (AU) 2011-11-17 — — WO disclosed
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