SCHEMBL5022852

SCHEMBL5022852

O[C@@H](CN1CCN(Cc2ccc(F)cc2)CC1)Cn1c2ccc(Br)cc2c2cc(Br)ccc21

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BAX Q07812 2/20 0.63
▸ MAPK1 P28482 3/20 0.62
▸ MAPT P10636 3/20 0.62
▸ TP53 P04637 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ ALOX15 P16050 1/20 0.62
▸ RAD52 P43351 2/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ LMNA P02545 3/20 0.56
▸ GAA P10253 1/20 0.56
▸ HTT P42858 2/20 0.52
▸ DNM1 Q05193 4/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NLRP1 Q9C000 1/20 0.50
▸ CACNA1G O43497 3/20 0.48
▸ KCNH2 Q12809 3/20 0.48
▸ PER2 O15055 1/20 0.47
▸ CRY2 Q49AN0 1/20 0.47

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
SCHEMBL605835 1.00 BAX (0.63) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL605834 1.00 BAX (0.63) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL607210 0.95 MEN1 (0.69) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL607023 0.88 LMNA (0.73) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL610266 0.88 BAX (0.60) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL607747 0.86 BAX (0.61) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL608481 0.86 BAX (0.61) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL6819686 0.86 BAX (0.82) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL5026887 0.86 BAX (0.63) BAXMAPK1MAPTTP53CYP3A4
SCHEMBL5022683 0.85 MAPK1 (0.72) BAXMAPK1MAPTTP53CYP3A4

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 5 patents. 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
EP-1094063-A1 9-(Piperazinylalkyl)carbazoles as Bax-modulators Applied Research Systems ARS Holding N.V. (AN) 2001-04-25 — — EP claimed
US-8410110-B2 9-(piperazinylalkyl) carbazoles as Bax-modulators MERCK SERONO SA (CH) 2013-04-02 — — US disclosed
EP-1237887-B1 9-(PIPERAZINYLALKYL)CARBAZOLES AS BAX-MODULATORS SERONO LAB (CH) 2008-06-04 — — EP disclosed
EP-1094063-A1 9-(Piperazinylalkyl)carbazoles as Bax-modulators Applied Research Systems ARS Holding N.V. (AN) 2001-04-25 — — EP disclosed
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