SCHEMBL5511022

SCHEMBL5511022

FC(F)(F)Oc1cccc(CNCC2C3CN(Cc4nc5ccccc5s4)CC23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 3/20 0.40
PRMT6 Q96LA8 3/20 0.40
BCHE P06276 1/20 0.38
ALDH1A1 P00352 1/20 0.37
DRD4 P21917 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
KCNH2 Q12809 3/20 0.36
SLC6A9 P48067 2/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 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
SCHEMBL708522 0.83 CARM1 (0.50) CARM1PRMT6BCHEDRD4KCNH2
SCHEMBL5511016 0.82 BCHE (0.53) BCHERAB9ASMN1; SMN2KCNH2KMT2A
SCHEMBL5513876 0.81 GRIN1 (0.43) CARM1PRMT6DRD4CYP2D6KCNH2
SCHEMBL5506387 0.81 HDAC3 (0.46) CARM1PRMT6BCHEDRD4CTSD
SCHEMBL712568 0.80 BACE1 (0.48) CARM1PRMT6BCHEALDH1A1DRD4
SCHEMBL5517990 0.79 CARM1 (0.43) CARM1PRMT6DRD4MAPK1KCNH2
SCHEMBL15967107 0.79 EGLN1 (0.42) CARM1PRMT6BCHEDRD4KCNH2
SCHEMBL15967210 0.79 CARM1 (0.45) CARM1PRMT6BCHEDRD4KCNH2
SCHEMBL710204 0.79 CXCR4 (0.45) CARM1PRMT6ALDH1A1DRD4CYP2D6
SCHEMBL5511194 0.79 MAPK14 (0.49) CARM1PRMT6BCHEALDH1A1DRD4

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