SCHEMBL2359406

SCHEMBL2359406

O=c1cnc2ccccc2n1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 13/20 0.51
▸ ALDH1A1 P00352 12/20 0.51
▸ HPGD P15428 3/20 0.51
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ HSD17B10 Q99714 5/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ TDP1 Q9NUW8 4/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ GMNN O75496 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ APEX1 P27695 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ LMNA P02545 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
SCHEMBL20703976 0.77 DAO (0.35) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL29580418 0.76 KDM4E (0.51) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL8861255 0.76 ALDH1A1 (0.51) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL28264383 0.76 KDM4E (0.51) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL7898823 0.76 KDM4E (0.56) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL29834958 0.76 KDM4E (0.51) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL6390410 0.76 KDM4E (0.51) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL28014515 0.74 RPS6KA5 (0.47) KDM4EMAPT
SCHEMBL30050771 0.73 ALDH1A1 (0.53) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL10722269 0.73 TDP1 (0.52) KDM4EALDH1A1HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450039-A1 DIHYDRO-1,2 OXO-2 QUINOXALINE DERIVATES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS. FABRE PIERRE COSMETIQUE (FR) 1991-10-09 — — EP claimed
EP-2352725-A1 QUINOXALINE-BASED LXR MODULATORS Wyeth LLC (US) 2011-08-10 — — EP disclosed
WO-2010054229-A1 QUINOXALINE-BASED LXR MODULATORS WYETH LLC (US) 2010-05-14 — — WO disclosed
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