SCHEMBL9377152

SCHEMBL9377152

CNC(=O)c1nc2cnc3ccccc3c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
APEX1 P27695 1/20 0.42
CYP2C19 P33261 1/20 0.42
THPO P40225 1/20 0.42
RAB9A P51151 1/20 0.42
PMP22 Q01453 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NUDT1 P36639 1/20 0.40
TOP2A P11388 2/20 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
SCHEMBL29468653 0.83 TNKS (0.42) KDM4ENPC1ALDH1A1LMNATP53
SCHEMBL9379083 0.82 TOP2A (0.46) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL9378888 0.81 TOP2A (0.42) KDM4EALDH1A1HPGDHSD17B10TOP2A
SCHEMBL9378032 0.81 CYP3A4 (0.42) KDM4EALDH1A1LMNATP53CYP1A2
SCHEMBL29468686 0.80 MEN1 (0.48) KDM4ENPC1ALDH1A1LMNATP53
SCHEMBL9380265 0.80 MEN1 (0.48) KDM4ENPC1ALDH1A1LMNATP53
SCHEMBL24642364 0.80 JAK1 (0.42)
SCHEMBL10385249 0.80 DAGLA (0.44) KDM4EALDH1A1LMNAMAPTRAB9A
SCHEMBL9383971 0.77 MEN1 (0.43) KDM4ENPC1ALDH1A1LMNATP53
SCHEMBL9381046 0.77 LMNA (0.44) KDM4EALDH1A1LMNAHPGDTSHR

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-0329073-B1 2-Substituted carbonylimidazo[4,5-c]quinolines SHIONOGI & CO (JP) 1994-12-28 EP disclosed
US-4940714-A 2-substituted carbonylimidazo[4,5-c]quinolines SHIONOGI & CO., LTD. (JP) 1990-07-10 US disclosed