SCHEMBL3971525

SCHEMBL3971525

O=C(O)COc1ccc(-c2ccc(NC(=O)c3cc(-c4ccc(-c5ccccc5)cc4)oc3C(F)(F)F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.54
MAPT P10636 8/20 0.53
ALDH1A1 P00352 6/20 0.53
HPGD P15428 2/20 0.53
KDM4E B2RXH2 3/20 0.49
PTGER4 P35408 1/20 0.48
PORCN Q9H237 1/20 0.46
SMO Q99835 1/20 0.46
PPARD Q03181 2/20 0.45
PPARA Q07869 1/20 0.45
PPARG P37231 1/20 0.45
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL4672508 0.92 ALDH1A1 (0.53) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL3972861 0.80 MAPT (0.57) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL4673447 0.78 MAPT (0.54) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL3972102 0.78 PPARG (0.50) DGAT1MAPTALDH1A1HPGDPPARA
SCHEMBL5983436 0.78 PPARG (0.50) DGAT1MAPTALDH1A1HPGDPPARA
SCHEMBL3978914 0.77 PPARG (0.59) MAPTKDM4EPPARAPPARG
SCHEMBL902999 0.77 P2RX1 (0.57) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL14927268 0.76 DGAT1 (0.56) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL3974895 0.75 PTPN1 (0.53) DGAT1MAPTALDH1A1HPGDKDM4E
SCHEMBL6259942 0.74 POLB (0.55) ALDH1A1PPARDPPARANPC1RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US claimed
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US disclosed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060020003-A1 Biphenyloxy-acids AHR, ARNT, NR1H4 DGAT1 1348/4885MAPT 4702/4885ALDH1A1 388/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.