SCHEMBL5026850

SCHEMBL5026850

O=C(O)N1CCN(C[C@H](O)Cn2c3ccccc3c3cc(Br)ccc32)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
RAD52 P43351 2/20 0.73
BAX Q07812 2/20 0.61
MAPT P10636 5/20 0.60
MAPK1 P28482 3/20 0.60
TP53 P04637 2/20 0.60
CYP3A4 P08684 1/20 0.60
ALOX15 P16050 1/20 0.60
LMNA P02545 3/20 0.57
GAA P10253 1/20 0.57
HTT P42858 2/20 0.56
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
POLB P06746 2/20 0.55
ATM Q13315 1/20 0.53
DNM1 Q05193 2/20 0.52
KDM4E B2RXH2 2/20 0.51
GLA P06280 1/20 0.51
ALDH1A1 P00352 2/20 0.49

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
SCHEMBL5024534 1.00 MEN1 (0.73) MEN1KMT2ARAD52BAXMAPT
SCHEMBL5024544 1.00 MEN1 (0.73) MEN1KMT2ARAD52BAXMAPT
SCHEMBL5110159 0.94 BAX (0.67) MEN1KMT2ARAD52BAXMAPT
SCHEMBL5025392 0.94 BAX (0.67) MEN1KMT2ARAD52BAXMAPT
SCHEMBL5087737 0.94 BAX (0.67) MEN1KMT2ARAD52BAXMAPT
SCHEMBL6815606 0.91 MEN1 (0.88) MEN1KMT2ARAD52BAXMAPT
SCHEMBL5026936 0.89 MEN1 (0.72) MEN1KMT2ARAD52MAPTMAPK1
SCHEMBL1305296 0.85 MEN1 (0.78) MEN1KMT2ARAD52BAXMAPT
SCHEMBL608201 0.85 MEN1 (0.64) MEN1KMT2ARAD52BAXMAPT
SCHEMBL606958 0.85 MEN1 (0.64) MEN1KMT2ARAD52BAXMAPT

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
EP-1237887-B1 9-(PIPERAZINYLALKYL)CARBAZOLES AS BAX-MODULATORS SERONO LAB (CH) 2008-06-04 EP claimed