SCHEMBL4701924

SCHEMBL4701924

Cc1ccc(Oc2ccccc2C2(O)CCN(C(=O)O)CC2)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.44
HTR3A P46098 2/20 0.44
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
OPRL1 P41146 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP46A1 Q9Y6A2 1/20 0.39
GRIN2B Q13224 2/20 0.39
CHRM4 P08173 1/20 0.39
CCR8 P51685 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36

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
SCHEMBL6002487 0.90 OPRM1 (0.40) OPRM1OPRD1OPRK1OPRL1L3MBTL1
SCHEMBL4702916 0.88 L3MBTL1 (0.57) HTR1AHTR3AL3MBTL1MEN1KMT2A
SCHEMBL4789410 0.86 HTR1A (0.42) HTR1AHTR3AL3MBTL1MEN1KMT2A
SCHEMBL6003541 0.84 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1CHRM4
SCHEMBL4702045 0.78 L3MBTL1 (0.56) OPRD1L3MBTL1SMN1; SMN2KDM4EALDH1A1
SCHEMBL6003865 0.77 OPRM1 (0.52) OPRM1OPRD1OPRK1OPRL1MEN1
SCHEMBL5368473 0.77 DRD2 (0.55) OPRM1OPRD1OPRK1OPRL1L3MBTL1
SCHEMBL5373284 0.77 OPRM1 (0.60) OPRM1OPRD1OPRK1OPRL1L3MBTL1
SCHEMBL4701060 0.76 PDK2 (0.43) L3MBTL1MEN1KMT2A
SCHEMBL5375989 0.72 DRD2 (0.44) HTR1AOPRM1OPRD1OPRK1OPRL1

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
EP-1635828-B1 4-(2-PHENYLOXYPHENYL)-PIPERIDINE OR -1,2,3,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS LUNDBECK & CO AS H (DK) 2008-04-23 EP disclosed
US-20060293360-A1 4-(2-Phenyloxyphenyl)-piperidine or-1,2,3,6-tetrahydropyridine derivatives as serotonin reuptake inhibitors H. LUNDBECK A/S (DK) 2006-12-28 US disclosed
EP-1635828-A1 4-(2-PHENYLOXYPHENYL)-PIPERIDINE OR -1,2,3,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. Lundbeck A/S (DK) 2006-03-22 EP disclosed
WO-2004087155-A1 4-(2-PHENYLOXYPHENYL)-PIPERIDINE OR -1,2,3,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. LUNDBECK A/S (DK) 2004-10-14 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-20060293360-A1 4-(2-Phenyloxyphenyl)-piperidine or-1,2,3,6-tetrahydropyridine derivatives as serotonin reuptake inhibitors HTR1D, TPH1, HTR2C HTR1A 5/4885HTR3A 14/4885OPRM1 59/4885

“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.