SCHEMBL28011963

SCHEMBL28011963

Clc1ccc(C2(CCBr)OCCO2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
KDM1A O60341 1/20 0.36
UTS2R Q9UKP6 3/20 0.35
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC6A2 P23975 3/20 0.31
POLB P06746 1/20 0.31
CHRNA1 P02708 1/20 0.31
CHRNG P07510 1/20 0.31
CHRNB1 P11230 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31

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
SCHEMBL11239172 0.89 MAOA (0.34) MAOAMAOBKDM1AUTS2RSLC6A4
SCHEMBL117206 0.85 MAOA (0.38) MAOAMAOBKDM1AUTS2RSLC6A4
SCHEMBL11234154 0.83 SLC6A4 (0.35) MAOAMAOBKDM1AUTS2RSLC6A4
SCHEMBL11240325 0.83 SLC6A4 (0.33) MAOAMAOBKDM1AUTS2RSLC6A4
SCHEMBL28011998 0.81 EGFR (0.40) MAOAMAOBSLC6A4SLC6A3LMNA
SCHEMBL7877014 0.81 SLC6A4 (0.41) MAOAMAOBKDM1ASLC6A4SLC6A3
SCHEMBL7390254 0.81 L3MBTL1 (0.45) MAOAMAOBALDH1A1TSHRMAPK1
SCHEMBL10849609 0.80 ALDH1A1 (0.38) MAOAMAOBKDM1AUTS2RSLC6A4
SCHEMBL1593327 0.80 ALDH1A1 (0.33) MAOAMAOBKDM1AUTS2RSLC6A4
Phosphine SCHEMBL9482786 0.79 L3MBTL1 (0.44) MAOAMAOBALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102480956-B Pyrido [4,3-b] indoles and methods of use MEDIVATION TECHNOLOGIES INC 2015-04-08 CN disclosed