SCHEMBL3910173

SCHEMBL3910173

O=C(OCc1ccccc1)N1CCC(C(=O)O)(c2ccc(F)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.57
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
CYP2C19 P33261 1/20 0.49
KDM1A O60341 2/20 0.48
OPRD1 P41143 1/20 0.48
OPRK1 P41145 1/20 0.48
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
TET3 O43151 1/20 0.46
FBXL19 Q6PCT2 1/20 0.46
CXXC5 Q7LFL8 1/20 0.46
TET1 Q8NFU7 1/20 0.46
KDM2B Q8NHM5 1/20 0.46

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
SCHEMBL2467789 0.91 KMT2A (0.58) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL3899809 0.91 RORC (0.55) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL8696969 0.86 RORC (0.58) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL17187989 0.86 KMT2A (0.52) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL16042582 0.85 RORC (0.57) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL2470472 0.84 OPRL1 (0.56) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL2918643 0.83 OPRM1 (0.50) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL29087277 0.82 RORC (0.61) RORCKMT2AMEN1NPSR1SMN1; SMN2
SCHEMBL3901930 0.81 OPRD1 (0.56) KMT2AMEN1NPSR1SMN1; SMN2RAB9A
SCHEMBL16639868 0.81 SMN1; SMN2 (0.59) RORCKMT2AMEN1NPSR1SMN1; SMN2

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
US-7521449-B2 4-arylmorpholin-3-one derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-04-21 US disclosed
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 US 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-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF ADRB3, ADRA2C, OPRK1 RORC 297/4885KMT2A 3890/4885MEN1 3003/4885

“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.