SCHEMBL5810293

SCHEMBL5810293

Cc1c(C)n(Cc2ccccc2)c2c(OCc3ccc(F)cc3)nc(C(=O)N3CCOCC3)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NMT2 O60551 1/20 0.41
NMT1 P30419 1/20 0.41
POLB P06746 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL5806323 0.86 FABP4 (0.46) HPGDKDM4EMAPTKMT2AMEN1
SCHEMBL5806454 0.84 GRM2 (0.43) HPGDKDM4EMAPTKMT2AMEN1
SCHEMBL3842414 0.84 MAPT (0.49) KDM4EMAPTHTTKMT2AMEN1
Hydrochloric Acid SCHEMBL1736846 0.83 MAPT (0.49) KDM4EMAPTHTTKMT2AMEN1
SCHEMBL5806342 0.83 CYP1A2 (0.41) HPGDKDM4EMAPTKMT2AMEN1
SCHEMBL5810949 0.83 PSEN1 (0.42) HPGDMAPTKMT2AMEN1ALDH1A1
SCHEMBL5809965 0.82 MAPT (0.47) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL5810806 0.81 CNR2 (0.49) PRKAA2
SCHEMBL5806065 0.79 CYP1A2 (0.46) HPGDKDM4ELMNAMAPTHTT
SCHEMBL5812303 0.78 CYP1A2 (0.46) HPGDLMNAMAPTHTTKMT2A

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-2006025717-A1 PYRROLO[2,3-c]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed