SCHEMBL6034342

SCHEMBL6034342

CCOC(=O)C1=Cc2sccc2N(C(=O)OC(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.42
POLB P06746 3/20 0.34
HSD17B10 Q99714 2/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP2C9 P11712 2/20 0.33
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RAB9A P51151 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPK1 P28482 1/20 0.32
BCHE P06276 1/20 0.32
CNR2 P34972 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL9835855 0.67 ALDH1A1 (0.39) TSHRPOLBHSD17B10KDM4ECYP2C9
SCHEMBL6034341 0.62 TSHR (0.35) TSHRPOLBHSD17B10CYP2C9LMNA
SCHEMBL9057095 0.60 TSHR (0.38) TSHRPOLBHSD17B10KDM4ECYP2C9
SCHEMBL15124256 0.59 CA1 (0.63) LMNAMAPTALDH1A1TDP1RAB9A
SCHEMBL9831889 0.59 MAPT (0.32) LMNAMAPT
SCHEMBL8950215 0.59 HSD11B1 (0.44) TSHRPOLBHSD17B10KDM4ECYP2C9
SCHEMBL25060076 0.59 MAPT (0.42) TSHRPOLBHSD17B10KDM4ELMNA
SCHEMBL12426342 0.59 TSHR (0.44) TSHRPOLBHSD17B10KDM4ELMNA
SCHEMBL9058353 0.58 TSHR (0.40) TSHRPOLBHSD17B10KDM4ECYP2C9
SCHEMBL15614500 0.58 KMT2A (0.47) TSHRPOLBHSD17B10KDM4ECYP2C9

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-1735320-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2006-12-27 EP disclosed
WO-2005097806-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2005-10-20 WO disclosed