SCHEMBL708327

SCHEMBL708327

Fc1ccc(CNCC2C3CNCC23)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.47
PTPN7 P35236 6/20 0.44
DUSP3 P51452 6/20 0.44
SLC6A4 P31645 1/20 0.43
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
CYP3A4 P08684 1/20 0.38
SLC6A9 P48067 1/20 0.38
KCNH2 Q12809 1/20 0.38
SLC6A5 Q9Y345 1/20 0.38
AR P10275 1/20 0.38
NR3C2 P08235 1/20 0.36
SOS1 Q07889 1/20 0.35
FPR3 P25089 1/20 0.35
FPR2 P25090 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
Hydrochloric Acid SCHEMBL711110 0.99 P2RX7 (0.47) P2RX7PTPN7DUSP3SLC6A4JAK2
SCHEMBL3770722 0.87 P2RX7 (0.44) P2RX7PTPN7DUSP3SLC6A4JAK2
SCHEMBL3773434 0.82 P2RX7 (0.48) P2RX7PTPN7DUSP3JAK2JAK1
SCHEMBL15967241 0.81 PRMT5 (0.47) SLC6A4CYP3A4SLC6A9KCNH2SOS1
SCHEMBL712501 0.81 P2RX7 (0.43) P2RX7PTPN7DUSP3JAK2JAK1
SCHEMBL3773846 0.80 P2RX7 (0.47) P2RX7PTPN7DUSP3JAK2JAK1
Hydrochloric Acid SCHEMBL709865 0.80 PRMT5 (0.46) SLC6A4CYP3A4SLC6A9KCNH2SOS1
SCHEMBL5510202 0.78 JAK2 (0.46) P2RX7PTPN7DUSP3JAK2JAK1
SCHEMBL3776355 0.77 P2RX7 (0.44) P2RX7PTPN7DUSP3JAK2JAK1
SCHEMBL5513104 0.77 DPP7 (0.47) P2RX7SLC6A4CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
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 2105/4885PTPN7 4420/4885DUSP3 4428/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 P2RX7 1885/4885PTPN7 4482/4885DUSP3 4487/4885

“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.