SCHEMBL2532028

SCHEMBL2532028

COC1(c2cc(F)cc(Cl)c2)CCN(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
SCD5 Q86SK9 1/20 0.35
SPR P35270 4/20 0.34
METAP2 P50579 1/20 0.34
PROKR1 Q8TCW9 4/20 0.33
CACNA1H O95180 2/20 0.33
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
S1PR2 O95136 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL2532421 0.91 SCD5 (0.39) DRD2SCD5SPRCACNA1HUSP2
SCHEMBL2423294 0.85 RORC (0.41) SCD5
SCHEMBL2526910 0.81 DRD2 (0.40) DRD2SCD5KDM4EALDH1A1
SCHEMBL2534867 0.80 SCD5 (0.39) DRD2SCD5USP2CYP3A4CYP2C19
SCHEMBL2531711 0.79 DRD2 (0.43) DRD2FFAR4SPRMETAP2PROKR1
SCHEMBL2426214 0.77 DRD2 (0.39) DRD2FFAR4METAP2
SCHEMBL9186072 0.77 ESR1 (0.36) DRD2SCD5SPRUSP2CYP3A4
SCHEMBL3384895 0.76 DRD2 (0.47) DRD2FFAR4METAP2KDM4ECYP3A4
SCHEMBL23706066 0.76 SCD5 (0.52) SCD5USP2CYP3A4CYP2C19HSD17B10
SCHEMBL2428683 0.75 RORC (0.43) SCD5

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-8673962-B2 3-phenyl-3-methoxypyrrolidine derivatives as modulators of cortical catecholaminergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2014-03-18 US disclosed
EP-2367787-B1 3-PHENYL-3-METHOXYPYRROLIDINE DERIVATIVES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB AF NEUROSEARCH SWEDEN AB (DK) 2013-01-09 EP disclosed
US-20110257241-A1 3-PHENYL-3-METHOXYPYRROLIDINE DERIVATIVES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2011-10-20 US disclosed
US-20110257242-A1 3-PHENYL-3-METHOXYPYRROLIDINE DERIVATIVES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2011-10-20 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 (2 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-20110257242-A1 3-PHENYL-3-METHOXYPYRROLIDINE DERIVATIVES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION PNMT, COMT, SLC6A3 DRD2 12/4885FFAR4 1856/4885SCD5 3094/4885
US-20110257241-A1 3-PHENYL-3-METHOXYPYRROLIDINE DERIVATIVES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION PNMT, COMT, SLC6A3 DRD2 14/4885FFAR4 1795/4885SCD5 3047/4885

“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.