SCHEMBL4014189

SCHEMBL4014189

NC(=O)c1ccc(Oc2ccc(CNCC3CCOCC3)cc2F)cc1O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.40
TTK P33981 8/20 0.40
ALDH2 P05091 1/20 0.40
MCHR1 Q99705 1/20 0.39
PPARD Q03181 1/20 0.38
PARP10 Q53GL7 2/20 0.37
PARP15 Q460N3 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
CTSD P07339 2/20 0.36
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL4016168 0.86 ATM (0.45) LMNA
SCHEMBL4017274 0.85 PPARD (0.39) ROCK2MCHR1PPARDPARP10PARP15
SCHEMBL4018723 0.80 OPRM1 (0.41) ROCK2TTKMCHR1PARP10PARP15
SCHEMBL4018970 0.78 CARM1 (0.42) PPARDOPRM1OPRD1OPRK1LMNA
SCHEMBL4019647 0.77 FPR2 (0.38) ROCK2PPARDPARP10OPRM1OPRD1
SCHEMBL4019651 0.77 PARP10 (0.40) ROCK2PARP10PARP15OPRM1OPRD1
SCHEMBL4024256 0.76 DRD4 (0.46) PPARDOPRM1OPRD1OPRK1LMNA
SCHEMBL4017097 0.76 PPARD (0.42) ROCK2PPARDLMNAHTT
SCHEMBL4024269 0.76 LMNA (0.42) ROCK2PPARDOPRM1OPRD1OPRK1
SCHEMBL13622917 0.75 MAOB (0.44) MCHR1PPARDHTT

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 ROCK2 2928/4885TTK 4685/4885ALDH2 799/4885

“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.