SCHEMBL5506772

SCHEMBL5506772

Clc1ccc(CNCC2C3CNCC23)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.61
WDR77 Q9BQA1 1/20 0.61
SLC6A4 P31645 4/20 0.44
CYP1A2 P05177 3/20 0.44
CYP2D6 P10635 3/20 0.44
CYP2C9 P11712 3/20 0.44
CYP2C19 P33261 3/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A3 Q01959 3/20 0.44
CYP3A4 P08684 2/20 0.44
KCNH2 Q12809 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 2/20 0.42
POLB P06746 2/20 0.40
HPGD P15428 1/20 0.40
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL15967241 0.87 PRMT5 (0.47) PRMT5WDR77SLC6A4CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL709865 0.86 PRMT5 (0.46) PRMT5WDR77SLC6A4CYP1A2CYP2D6
SCHEMBL15967360 0.81 CHRM2 (0.50) SLC6A4CYP1A2CYP2D6CYP2C19CYP3A4
SCHEMBL5510485 0.80 PRMT5 (0.37) PRMT5WDR77
SCHEMBL3783316 0.79 PRMT5 (0.51) PRMT5WDR77SLC6A4CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL708458 0.79 CHRM2 (0.49) SLC6A4CYP1A2CYP2D6CYP2C19CYP3A4
SCHEMBL18726738 0.79 SLC6A4 (0.50) PRMT5WDR77SLC6A4CYP1A2CYP2D6
SCHEMBL3783254 0.77 PRMT5 (0.49) PRMT5WDR77CYP1A2CYP2D6CYP2C9
SCHEMBL5509008 0.75 TSHR (0.47) TSHRHPGDALDH1A1LMNA
SCHEMBL3777733 0.74 PRMT5 (0.41) PRMT5WDR77SLC6A4CYP2C9SLC6A2

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