SCHEMBL2474561

SCHEMBL2474561

C#CCN(C)C(COS(=O)(=O)c1ccc(Br)cc1)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.52
MAOA P21397 7/20 0.46
CYP1A2 P05177 2/20 0.46
TSHR P16473 2/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
ADRA1A P35348 1/20 0.46
SNCA P37840 1/20 0.46
OPRK1 P41145 1/20 0.46
CYP2D6 P10635 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.45
KDM4E B2RXH2 1/20 0.45
PYCR1 P32322 5/20 0.40
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
MMP2 P08253 2/20 0.36
MMP1 P03956 1/20 0.36
MMP3 P08254 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
SCHEMBL2474560 1.00 MAOB (0.52) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2477504 0.90 MAOB (0.53) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2477505 0.90 MAOB (0.53) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2477506 0.90 MAOB (0.53) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2474342 0.82 MAOB (0.60) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2474070 0.82 MAOB (0.60) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2474314 0.82 MAOB (0.60) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL18756729 0.80 MAOB (0.58) MAOBMAOACYP1A2TSHRADRA2A
SCHEMBL2474429 0.73 MAOB (0.57) MAOBTSHRPKMMAPK1KDM4E
SCHEMBL2474432 0.73 MAOB (0.57) MAOBTSHRPKMMAPK1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2388245-A1 Compounds for use in imaging, diagnosing and/or treatment of diseases of the central nervous system or of tumors Bayer Pharma AG (DE) 2011-11-23 EP disclosed
US-20110254522-A1 STANDBY POWER SUPPLY CIRCUIT HON HAI PRECISION INDUSTRY CO., LTD. (TW) 2011-10-20 US disclosed
EP-2374779-A1 Compounds for use in imaging, diagnosing and/or treatment of diseases of the central nervous system or of tumors Bayer Pharma Aktiengesellschaft (DE) 2011-10-12 EP disclosed