SCHEMBL16622980

SCHEMBL16622980

N[C@H]1C[C@@H](Oc2ccc(Br)cc2)C1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
KDM1A O60341 6/20 0.42
MAOB P27338 3/20 0.42
KCNH2 Q12809 2/20 0.42
RCOR1 Q9UKL0 2/20 0.42
KDM1B Q8NB78 1/20 0.42
SLC6A4 P31645 5/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A3 Q01959 3/20 0.38
EPHX2 P34913 2/20 0.38
MAOA P21397 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
FURIN P09958 2/20 0.36
PARP10 Q53GL7 1/20 0.34

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
Hydrochloric Acid SCHEMBL25300505 0.98 KDM1A (0.44) MAPTKDM1AMAOBKCNH2RCOR1
Hydrochloric Acid SCHEMBL25308699 0.98 KDM1A (0.44) MAPTKDM1AMAOBKCNH2RCOR1
Hydrochloric Acid SCHEMBL25300504 0.98 KDM1A (0.44) MAPTKDM1AMAOBKCNH2RCOR1
SCHEMBL9913849 0.79 SLC6A4 (0.59) MAPTMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL9913891 0.79 SLC6A4 (0.59) MAPTMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL30230283 0.79 TEAD4 (0.43) MAPTMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL23951609 0.79 KDM1A (0.42) KDM1ASLC6A4SLC6A2SLC6A3EPHX2
SCHEMBL23951657 0.79 TEAD4 (0.43) MAPTMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL30182887 0.78 SLC6A2 (0.57) KDM1AMAOBKCNH2RCOR1SLC6A4
SCHEMBL20046785 0.78 SLC6A2 (0.57) KDM1AMAOBKCNH2RCOR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857404-B1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO CO LTD (JP) 2017-08-23 EP disclosed
EP-2857404-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVE AS KINASE INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2015-04-08 EP disclosed