SCHEMBL5087776

SCHEMBL5087776

OC(CN1CCN(Cc2cc(Br)co2)CC1)Cn1c2ccccc2c2cc(Br)ccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.68
MEN1 O00255 3/20 0.68
RAD52 P43351 2/20 0.68
BAX Q07812 1/20 0.56
LMNA P02545 4/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 6/20 0.55
MAPK1 P28482 4/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
ALOX15 P16050 1/20 0.55
ATM Q13315 1/20 0.52
POLB P06746 2/20 0.51
HTT P42858 4/20 0.49
NPSR1 Q6W5P4 2/20 0.48
DNM1 Q05193 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 1/20 0.48
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL606935 0.88 KMT2A (0.68) KMT2AMEN1RAD52BAXLMNA
SCHEMBL6815606 0.87 MEN1 (0.88) KMT2AMEN1RAD52BAXLMNA
SCHEMBL1305296 0.82 MEN1 (0.78) KMT2AMEN1RAD52BAXLMNA
SCHEMBL610230 0.81 MEN1 (0.73) KMT2AMEN1RAD52BAXLMNA
SCHEMBL6819686 0.81 BAX (0.82) KMT2AMEN1RAD52BAXLMNA
SCHEMBL607402 0.80 RAD52 (0.69) KMT2AMEN1RAD52BAXLMNA
SCHEMBL607109 0.80 MEN1 (0.69) KMT2AMEN1RAD52BAXLMNA
SCHEMBL607057 0.80 MEN1 (0.69) KMT2AMEN1RAD52BAXLMNA
SCHEMBL607210 0.80 MEN1 (0.69) KMT2AMEN1RAD52BAXLMNA
SCHEMBL607023 0.80 LMNA (0.73) KMT2AMEN1RAD52BAXLMNA

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