SCHEMBL8673292

SCHEMBL8673292

CCCCc1cc(CO)c2ccccc2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.55
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
DHODH Q02127 1/20 0.49
PARP1 P09874 1/20 0.48
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 2/20 0.47
TLR8 Q9NR97 2/20 0.46
CYP3A4 P08684 2/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
LMNA P02545 2/20 0.44
CYP1A2 P05177 2/20 0.44
ABCB11 O95342 1/20 0.44
CYP2D6 P10635 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
SCHEMBL9179529 0.92 MEN1 (0.53) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL8673322 0.85 KDM4E (0.54) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL8671753 0.83 CYP1A2 (0.53) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL660585 0.83 KDM4E (0.44) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL3970182 0.82 KDM4E (0.49) KDM4EALDH1A1GAAHPGDGLA
SCHEMBL7852029 0.82 MEN1 (0.51) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL8671748 0.82 MEN1 (0.51) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL28014894 0.82 NCF1 (0.53) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL8673320 0.82 KDM4E (0.54) KDM4EMEN1KMT2ADHODHPARP1
SCHEMBL9187156 0.81 KDM4E (0.64) KDM4EMEN1KMT2APARP1ALDH1A1

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-5817674-A ANTIOTENSIN II RECEPTOR ANTAGONISTS ROUSSEL UCLAF (FR) 1998-10-06 US disclosed