SCHEMBL4019647

SCHEMBL4019647

NC(=O)c1ccc(Oc2ccc(CNCC3(O)CCCCC3)cc2F)cc1O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.38
SCN9A Q15858 1/20 0.38
PPARD Q03181 1/20 0.38
OPRK1 P41145 7/20 0.37
OPRM1 P35372 6/20 0.37
OPRD1 P41143 6/20 0.37
HDAC6 Q9UBN7 1/20 0.36
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
DRD4 P21917 1/20 0.35
CARM1 Q86X55 2/20 0.34
PRMT6 Q96LA8 2/20 0.34
PARP10 Q53GL7 1/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33

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
SCHEMBL4018667 0.89 FPR2 (0.39) FPR2SCN9AHDAC6DRD4PARP10
SCHEMBL4017274 0.79 PPARD (0.39) PPARDOPRK1OPRM1OPRD1LMNA
SCHEMBL4018970 0.78 CARM1 (0.42) PPARDOPRK1OPRM1OPRD1LMNA
SCHEMBL4014189 0.77 ROCK2 (0.40) PPARDOPRK1OPRM1OPRD1LMNA
SCHEMBL4016168 0.77 ATM (0.45) LMNAALDH1A1
SCHEMBL4019651 0.77 PARP10 (0.40) OPRK1OPRM1OPRD1LMNAHTT
SCHEMBL4017097 0.76 PPARD (0.42) PPARDLMNAHTTCARM1PRMT6
SCHEMBL4024256 0.76 DRD4 (0.46) PPARDOPRK1OPRM1OPRD1HDAC6
SCHEMBL4024269 0.74 LMNA (0.42) PPARDOPRK1OPRM1OPRD1LMNA
SCHEMBL13622917 0.69 MAOB (0.44) PPARDHTTCARM1PRMT6MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618996-B2 Diaryl ether derivatives and uses thereof PFIZER INC. (US) 2009-11-17 US claimed
EP-2064199-A1 DIARYL ETHER DERIVATIVES AND USES THEREOF Pfizer Products Inc. (US) 2009-06-03 EP claimed
WO-2008032156-A1 DIARYL ETHER DERIVATIVES AND USES THEREOF PFIZER PRODUCTS INC. (US) 2008-03-20 WO claimed
US-20080070887-A1 Diaryl Ether Derivatives and Uses Thereof PFIZER INC 2008-03-20 US claimed

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-20080070887-A1 Diaryl Ether Derivatives and Uses Thereof OPRD1, OPRK1, OPRL1 FPR2 875/4885SCN9A 819/4885PPARD 230/4885

“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.