SCHEMBL5506362

SCHEMBL5506362

FC(F)(F)Oc1cccc(CNCC2C3CN(Cc4c[nH]cn4)CC23)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 3/20 0.44
PRMT6 Q96LA8 3/20 0.44
SLC6A9 P48067 6/20 0.41
KCNH2 Q12809 6/20 0.41
CTSD P07339 1/20 0.37
BACE1 P56817 1/20 0.37
KCNN3 Q9UGI6 1/20 0.37
DRD4 P21917 2/20 0.36
SCD O00767 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
GRM2 Q14416 1/20 0.35
CHRM3 P20309 1/20 0.35
SCN5A Q14524 1/20 0.35
SCN9A Q15858 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A5 Q9Y345 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
SCHEMBL708522 0.85 CARM1 (0.50) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL5509542 0.83 CARM1 (0.43) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL712568 0.82 BACE1 (0.48) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL5514030 0.82 CARM1 (0.43) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL5518370 0.81 CARM1 (0.42) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL5508994 0.81 CARM1 (0.46) CARM1PRMT6SLC6A9KCNH2SCD
SCHEMBL5511564 0.81 CARM1 (0.42) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL15967022 0.81 CHRM3 (0.45) SLC6A9KCNH2CHRM3
SCHEMBL5512185 0.81 CARM1 (0.48) CARM1PRMT6SLC6A9KCNH2CTSD
SCHEMBL5514667 0.81 CARM1 (0.46) CARM1PRMT6SLC6A9KCNH2CTSD

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
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