SCHEMBL5504632

SCHEMBL5504632

CN(Cc1cccs1)C(=O)CN1CC2C(CNCc3cccc(OC(F)(F)F)c3)C2C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 10/20 0.43
KCNH2 Q12809 8/20 0.43
CARM1 Q86X55 2/20 0.40
PRMT6 Q96LA8 2/20 0.40
ATM Q13315 2/20 0.38
CYP2D6 P10635 5/20 0.38
SLC6A5 Q9Y345 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
USP2 O75604 1/20 0.38
GFER P55789 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP3A4 P08684 3/20 0.37
RAB9A P51151 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD11B1 P28845 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL15967026 0.88 SLC6A9 (0.45) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5506353 0.87 SLC6A9 (0.43) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL15966928 0.86 SLC6A9 (0.44) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5504629 0.85 GAA (0.41) SLC6A9KCNH2MEN1KMT2AUSP2
SCHEMBL5510569 0.85 SLC6A9 (0.43) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5517997 0.85 CARM1 (0.46) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5515991 0.84 SLC6A9 (0.44) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5509498 0.84 SLC6A9 (0.48) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5510551 0.83 LTB4R (0.43) SLC6A9KCNH2CARM1PRMT6ATM
SCHEMBL5504912 0.82 CARM1 (0.42) SLC6A9KCNH2CARM1PRMT6ATM

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