SCHEMBL13229574

SCHEMBL13229574

CC(C)(C)OC(=O)N1CCN([C@@H]2CN(Cc3ccccc3)C[C@H]2O)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 3/20 0.48
GPR119 Q8TDV5 2/20 0.46
STS P08842 1/20 0.46
FUCA1 P04066 2/20 0.46
TP53 P04637 2/20 0.45
THRB P10828 1/20 0.45
MAPT P10636 1/20 0.45
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 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
SCHEMBL13229637 1.00 SLC18A3 (0.48) SLC18A3GPR119STSFUCA1TP53
SCHEMBL13229639 1.00 SLC18A3 (0.48) SLC18A3GPR119STSFUCA1TP53
SCHEMBL13229638 1.00 SLC18A3 (0.48) SLC18A3GPR119STSFUCA1TP53
SCHEMBL13229596 0.89 SLC18A3 (0.49) SLC18A3
SCHEMBL2793784 0.89 SLC18A3 (0.49) SLC18A3
SCHEMBL2847210 0.86 L3MBTL1 (0.51) SLC18A3FUCA1MAPT
SCHEMBL13229594 0.86 L3MBTL1 (0.51) SLC18A3FUCA1MAPT
SCHEMBL13229605 0.85 GPR119 (0.43) GPR119STSTP53THRBMAPT
SCHEMBL13229742 0.83 SLC18A3 (0.54) SLC18A3FUCA1
SCHEMBL2796545 0.83 SLC18A3 (0.54) SLC18A3FUCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168093-A1 SUBSTITUTED 3-AMINO-4 -HYDROXY PYRROLIDINES COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIES DE DR. ESTEVE, S.A. (ES) 2010-07-01 US disclosed
US-20100168093-A1 SUBSTITUTED 3-AMINO-4 -HYDROXY PYRROLIDINES COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIES DE DR. ESTEVE, S.A. (ES) 2010-07-01 US disclosed
EP-1849781-A1 Substituted 3-Amino-4-hydroxy pyrrolidines compounds, their preparation and use as medicaments Laboratorios del Dr. Esteve S.A. (ES) 2007-10-31 EP 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-20100168093-A1 SUBSTITUTED 3-AMINO-4 -HYDROXY PYRROLIDINES COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS PAH, HMBS, P4HA1 SLC18A3 1740/4885GPR119 3675/4885STS 2303/4885

“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.