SCHEMBL5510236

SCHEMBL5510236

FC(F)(F)c1cccc(CCNCC2C3CNCC23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
ROCK1 Q13464 1/20 0.44
CNR1 P21554 1/20 0.43
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
PARP1 P09874 1/20 0.42
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
SLC6A4 P31645 2/20 0.40
DPP7 Q9UHL4 1/20 0.40
MIF P14174 1/20 0.40
GRM2 Q14416 1/20 0.40
GRM3 Q14832 1/20 0.40

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
SCHEMBL5513104 0.90 DPP7 (0.47) MEN1KMT2ATDP1HTR2AHTR2C
Hydrochloric Acid SCHEMBL709536 0.88 DPP7 (0.46) MEN1KMT2ATDP1HTR2AHTR2C
SCHEMBL15967032 0.80 TAAR1 (0.49) MEN1KMT2ATAAR1CNR1HTR2C
SCHEMBL5510229 0.78 MEN1 (0.53) KDM4EMEN1KMT2A
SCHEMBL3783229 0.77 P2RX7 (0.42) KDM4EMEN1KMT2ANOS1NOS2
SCHEMBL3783236 0.74 ATM (0.37) HTR2AHTR2CHTR2BNOS1NOS2
SCHEMBL24168829 0.72 CARM1 (0.57) MEN1KMT2ATAAR1TDP1NOS1
SCHEMBL30334887 0.72 CARM1 (0.57) MEN1KMT2ATAAR1TDP1NOS1
SCHEMBL22579188 0.72 KDM4E (0.63) KDM4EMEN1KMT2ATAAR1TDP1
SCHEMBL10562876 0.72 TAAR1 (0.56) KDM4EMEN1KMT2ATAAR1TDP1

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