SCHEMBL6652646

SCHEMBL6652646

CCN(c1ccccc1)c1cccc2nc3ccccc3cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
GLA P06280 2/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
PTBP1 P26599 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
RCE1 Q9Y256 1/20 0.47
APAF1 O14727 1/20 0.43
CASP3 P42574 1/20 0.43
CASP6 P55212 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
MAPT P10636 2/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL9755385 0.84 ALDH1A1 (0.47) ALDH1A1HPGDGLAKDM4EGAA
SCHEMBL29202173 0.82 ALDH1A1 (0.55) ALDH1A1HPGDGLAKDM4EGAA
SCHEMBL29387399 0.82 APAF1 (0.49) ALDH1A1KDM4EKMT2AAPAF1CASP3
SCHEMBL2185816 0.82 APAF1 (0.49) ALDH1A1KDM4EKMT2AAPAF1CASP3
SCHEMBL5348096 0.80 CRHR1 (0.50) ALDH1A1HPGDGLAKDM4EGAA
SCHEMBL93696 0.79 ALDH1A1 (0.51) ALDH1A1HPGDGLAKDM4EGAA
SCHEMBL2872359 0.78 KDM4E (0.55) ALDH1A1HPGDGLAKDM4EGAA
SCHEMBL14188176 0.78 APAF1 (0.46) ALDH1A1KDM4EKMT2AAPAF1CASP3
Hydrochloric Acid SCHEMBL8003436 0.77 ALDH1A1 (0.53) ALDH1A1HPGDGLAKDM4EGAA
Bromide SCHEMBL8003449 0.77 KDM4E (0.53) ALDH1A1HPGDGLAKDM4EGAA

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
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 WO disclosed