SCHEMBL711147

SCHEMBL711147

Fc1ccc(CNCC2C3CN(C4CCOCC4)CC23)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.42
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
PTPN7 P35236 3/20 0.35
DUSP3 P51452 3/20 0.35
DRD4 P21917 1/20 0.35
SLC6A9 P48067 2/20 0.34
KCNH2 Q12809 2/20 0.34
HTR4 Q13639 5/20 0.34
CYP3A4 P08684 2/20 0.33
ENPP2 Q13822 1/20 0.33
CYP2D6 P10635 1/20 0.33
AR P10275 1/20 0.33
EPHX1 P07099 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
SCHEMBL3776355 0.87 P2RX7 (0.44) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL3770722 0.85 P2RX7 (0.44) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL3773434 0.83 P2RX7 (0.48) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL3773846 0.81 P2RX7 (0.47) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL711146 0.81 P2RX7 (0.53) P2RX7PTPN7DUSP3ENPP2
SCHEMBL5510202 0.79 JAK2 (0.46) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL5505044 0.78 CXCR4 (0.43) P2RX7HTR4CYP3A4
SCHEMBL5506741 0.77 JAK2 (0.43) P2RX7JAK2JAK1TYK2JAK3
SCHEMBL5510189 0.77 GLS (0.44) DRD4SLC6A9KCNH2
SCHEMBL712501 0.77 P2RX7 (0.43) P2RX7JAK2JAK1TYK2JAK3

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-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed
US-8124639-B2 Bicyclic [3.1.0] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. (US) 2012-02-28 US disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 US disclosed
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. 2006-10-12 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-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors SLC1A2, SLC1A1, SLC6A5 P2RX7 2105/4885JAK2 3873/4885JAK1 3874/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 P2RX7 1885/4885JAK2 3963/4885JAK1 3941/4885

“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.