SCHEMBL5984477

SCHEMBL5984477

COC(=O)C1(OC)C=CC(c2ccccc2)C=C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
MAPT P10636 6/20 0.39
CYP3A4 P08684 4/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.38
ALOX15 P16050 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ATM Q13315 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ABCB1 P08183 1/20 0.34

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
SCHEMBL4234394 0.87 POLB (0.37) MAPTCYP3A4TSHRALDH1A1MEN1
SCHEMBL6903843 0.85 POLB (0.36) MAPTCYP3A4TSHRALDH1A1POLB
SCHEMBL11453583 0.83 HTT (0.41) HTTMAPTCYP3A4TSHRALDH1A1
SCHEMBL19746578 0.82 HTT (0.44) HTTMAPTCYP3A4TSHRALDH1A1
SCHEMBL8970777 0.82 MAPT (0.43) HTTMAPTCYP3A4TSHRALDH1A1
SCHEMBL9545947 0.78 POLB (0.36) MAPTTSHRMEN1KMT2AKDM4E
SCHEMBL9487252 0.77 TSHR (0.35) HTTMAPTTSHRALDH1A1MEN1
SCHEMBL10337980 0.74 TSHR (0.34) CYP3A4TSHRALDH1A1KMT2AKDM4E
SCHEMBL9466795 0.74 CHRNA7 (0.34) MAPTTSHRALDH1A1POLBATM
SCHEMBL404531 0.74 ANPEP (0.36)

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-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO disclosed