SCHEMBL7465330

SCHEMBL7465330

OC[C@@H]1CCN(CCc2ccccc2)C1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.64
ACHE P22303 1/20 0.57
HTR2A P28223 2/20 0.52
GBA1 P04062 1/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
TSHR P16473 1/20 0.52
HTR2C P28335 1/20 0.52
SLC6A3 Q01959 1/20 0.51

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
SCHEMBL843343 1.00 CCR3 (0.64) CCR3ACHEHTR2AGBA1KDM4E
SCHEMBL5069409 1.00 CCR3 (0.64) CCR3ACHEHTR2AGBA1KDM4E
SCHEMBL1918964 0.90 CCR3 (0.73) CCR3ACHEHTR2AKDM4ECYP1A2
SCHEMBL9682520 0.86 GBA1 (0.62) CCR3ACHEGBA1CYP2D6SLC6A3
SCHEMBL6172031 0.84 CCR3 (0.64) CCR3ACHESLC6A3
SCHEMBL843329 0.84 CCR3 (0.64) CCR3ACHESLC6A3
SCHEMBL11023730 0.84 CCR3 (0.64) CCR3ACHESLC6A3
SCHEMBL5779205 0.84 CCR3 (0.64) CCR3ACHESLC6A3
SCHEMBL8545766 0.83 CYP2D6 (0.68) CCR3ACHECYP1A2CYP3A4CYP2D6
SCHEMBL5968994 0.83 CYP2D6 (0.68) CCR3ACHECYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103626687-A Synthetic method for (3R)-1-[(R)-1-phenethyl]-3-hydroxymethyl pyrrolidine CHEMFUTURE PHARMATECH JIANGSU LTD 2014-03-12 CN disclosed
CN-103626687-A Synthetic method for (3R)-1-[(R)-1-phenethyl]-3-hydroxymethyl pyrrolidine CHEMFUTURE PHARMATECH JIANGSU LTD 2014-03-12 CN disclosed
CN-1093861-C 1-methylcarbapenem derivatives SANKYO CO (JP) 2002-11-06 CN disclosed
US-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission LIN NAN-HORNG (US) 2002-10-17 US disclosed
EP-1212319-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2002-06-12 EP disclosed
WO-2001019817-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 2001-03-22 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-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission GAP43, SLC18A2, GABRE CCR3 3204/4885ACHE 126/4885HTR2A 439/4885

“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.