SCHEMBL14199865

SCHEMBL14199865

COC(=O)c1cc(CSc2ccc(C)cc2)c(C)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.48
TSHR P16473 2/20 0.46
APEX1 P27695 1/20 0.46
MAPT P10636 7/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
LMNA P02545 3/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 2/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41

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
SCHEMBL3535955 0.90 HPGD (0.46) HPGDTSHRAPEX1MAPTALDH1A1
SCHEMBL3538298 0.82 HPGD (0.41) HPGDTSHRAPEX1MAPTALDH1A1
SCHEMBL3540319 0.81 PTGER4 (0.56) HPGDTSHRMAPTALDH1A1KDM4E
SCHEMBL14199639 0.77 MAPT (0.67) HPGDTSHRMAPTALDH1A1KDM4E
SCHEMBL3534389 0.75 TSHR (0.56) HPGDTSHRAPEX1MAPTALDH1A1
SCHEMBL3534546 0.73 TSHR (0.55) HPGDTSHRAPEX1MAPTALDH1A1
SCHEMBL28606522 0.70 HPGD (0.52) HPGDMAPTALDH1A1KDM4ELMNA
SCHEMBL6825954 0.69 L3MBTL1 (0.51) HPGDTSHRMAPTALDH1A1KDM4E
SCHEMBL3531970 0.69 PTGER4 (0.71) APEX1POLB
SCHEMBL12554580 0.69 L3MBTL1 (0.52) HPGDMAPTALDH1A1KDM4ELMNA

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
EP-1603893-B1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LTD (GB) 2008-05-21 EP disclosed