SCHEMBL2475396

SCHEMBL2475396

COC(=O)c1cc(F)ccc1CN1[C@@H](c2ncccc2C)CCC[C@H]1c1ncccc1C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.39
NTRK1 P04629 3/20 0.37
JAK2 O60674 1/20 0.37
CXCR4 P61073 2/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
OPRK1 P41145 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL2472903 0.89 ALOX15 (0.39) CXCR4KDM4ESMN1; SMN2
SCHEMBL2474896 0.89 ALOX15 (0.39) CXCR4KDM4ESMN1; SMN2
SCHEMBL2472806 0.89 P2RX7 (0.39) P2RX7CXCR4KDM4ELMNASMN1; SMN2
SCHEMBL8306824 0.88 KDM4E (0.38) CXCR4KDM4ELMNAOPRK1
SCHEMBL2472764 0.88 KDM4E (0.38) CXCR4KDM4ELMNAOPRK1
SCHEMBL8301697 0.87 KDM4E (0.42) CXCR4KDM4ELMNAOPRK1
SCHEMBL2470095 0.87 KDM4E (0.42) CXCR4KDM4ELMNAOPRK1
SCHEMBL8301571 0.87 KDM4E (0.37) CXCR4KDM4ELMNASMN1; SMN2OPRK1
SCHEMBL2476951 0.87 KDM4E (0.37) CXCR4KDM4ELMNASMN1; SMN2OPRK1
SCHEMBL2470480 0.86 HCRTR1 (0.38) P2RX7CXCR4

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
EP-2664617-A1 Method of making a 2,6-diaryl piperidine derivative Genzyme Corporation (US) 2013-11-20 EP disclosed
EP-1615633-B1 CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY GENZYME CORP (US) 2012-08-15 EP disclosed
EP-2374804-A1 Chemokine receptor binding heterocyclic compounds with enhanced efficacy Genzyme Corporation (US) 2011-10-12 EP disclosed
US-7550484-B2 Chemokine receptor binding heterocyclic compounds with enhanced efficacy GENZYME CORPORATION (US) 2009-06-23 US disclosed
US-7501518-B2 Methods of making 2,6-diaryl piperidine derivatives GENZYME CORPORATION (US) 2009-03-10 US disclosed
US-20050154201-A1 Methods of making 2,6-diaryl piperidine derivatives ANORMED CORPORATION (CA) 2005-07-14 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-20050154201-A1 Methods of making 2,6-diaryl piperidine derivatives ALDH7A1, DPYD, ALDH1A1 P2RX7 1136/4885NTRK1 3419/4885JAK2 1618/4885

“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.