SCHEMBL5504629

SCHEMBL5504629

CN(Cc1cccs1)C(=O)CN1CC2C(CNC(=O)c3cccc(OC(F)(F)F)c3)C2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
NAMPT P43490 1/20 0.40
CCR2 P41597 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
HTR2A P28223 1/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
SLC6A9 P48067 2/20 0.39
KCNH2 Q12809 2/20 0.39
CHRM3 P20309 1/20 0.39
GPR139 Q6DWJ6 1/20 0.39
BCHE P06276 1/20 0.38
USP2 O75604 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL15967025 0.87 GPR139 (0.44) NAMPTCCR2TAS1R3TAS1R1TAS1R2
SCHEMBL5506350 0.86 CCR2 (0.41) NAMPTCCR2KMT2ATAS1R3TAS1R1
SCHEMBL15966927 0.86 NAMPT (0.44) NAMPTCCR2TAS1R3TAS1R1TAS1R2
SCHEMBL5510565 0.85 POLB (0.40) NAMPTCCR2POLBSMN1; SMN2TAS1R3
SCHEMBL5504632 0.85 SLC6A9 (0.43) MEN1KMT2ASLC6A9KCNH2USP2
SCHEMBL5517992 0.85 NAMPT (0.46) NAMPTCCR2TAS1R3TAS1R1TAS1R2
SCHEMBL5509495 0.84 CCR2 (0.44) NAMPTCCR2TAS1R3TAS1R1TAS1R2
SCHEMBL5530668 0.82 NAMPT (0.46) NAMPTCCR2TAS1R3TAS1R1TAS1R2
SCHEMBL5510550 0.82 GPR139 (0.43) NAMPTCCR2MEN1KMT2ATAS1R3
SCHEMBL5504910 0.82 SLC6A9 (0.42) NAMPTCCR2TAS1R3TAS1R1TAS1R2

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