SCHEMBL8348585

SCHEMBL8348585

CNc1cc(C)ccc1N(C=O)CCN1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.39
POLB P06746 4/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
THRB P10828 1/20 0.38
MEN1 O00255 2/20 0.37
HKDC1 Q2TB90 1/20 0.37

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
SCHEMBL22725047 0.79 PKM (0.38) TSHR
SCHEMBL8350029 0.70 MAPK14 (0.38) KMT2APOLBALDH1A1
SCHEMBL4470439 0.67 DRD3 (0.36) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL25343971 0.65 PKM (0.51) KMT2AMAPTPOLBKDM4EALDH1A1
SCHEMBL30023522 0.65 PKM (0.51) KMT2AMAPTPOLBKDM4EALDH1A1
SCHEMBL30023712 0.65 DRD1 (0.46) MAPTHTTTSHRPOLBKDM4E
SCHEMBL24654438 0.64 ALDH1A1 (0.35) KMT2AMAPTTSHRPOLBKDM4E
SCHEMBL19203509 0.64 ALDH1A1 (0.48) KMT2AL3MBTL1MAPTHTTPOLB
SCHEMBL24289620 0.64 HRH3 (0.47) KMT2AMAPTHTTTSHRPOLB
SCHEMBL27942049 0.64 HSD17B10 (0.50) L3MBTL1TSHRPOLBKDM4EALDH1A1

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-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 WO disclosed