SCHEMBL5025290

SCHEMBL5025290

CC(C)(C)OC(=O)ON1CCN(CC(O)Cn2c3ccc(Cl)cc3c3cc(Cl)ccc32)CC1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.58
NLRP1 Q9C000 1/20 0.58
LMNA P02545 6/20 0.51
HTT P42858 4/20 0.51
MAPT P10636 3/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NPSR1 Q6W5P4 2/20 0.43
HSP90AA1 P07900 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
BAX Q07812 1/20 0.41
TP53 P04637 2/20 0.40
MAPK1 P28482 2/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL5022633 0.88 BAX (0.56) RAD52NLRP1LMNAHTTMAPT
SCHEMBL5025352 0.88 BAX (0.56) RAD52NLRP1LMNAHTTMAPT
SCHEMBL609732 0.85 RAD52 (0.61) RAD52NLRP1LMNAHTTMAPT
SCHEMBL5025336 0.85 MEN1 (0.60) RAD52LMNAHTTMAPTALDH1A1
SCHEMBL5025287 0.84 MEN1 (0.62) RAD52LMNAHTTMAPTALDH1A1
SCHEMBL5025317 0.84 MEN1 (0.62) RAD52LMNAHTTMAPTALDH1A1
SCHEMBL5022677 0.84 MEN1 (0.62) RAD52LMNAHTTMAPTALDH1A1
SCHEMBL6823233 0.81 RAD52 (0.86) RAD52NLRP1LMNAHTTMAPT
SCHEMBL5028634 0.80 RAD52 (0.41) RAD52NLRP1LMNAALDH1A1MEN1
SCHEMBL5087921 0.77 RAD52 (0.70) RAD52NLRP1LMNAHTTMAPT

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