SCHEMBL15568415

SCHEMBL15568415

Fc1ccc(Cn2c(-c3cccc(Br)c3)nc3ccccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 1.00
LMNA P02545 3/20 1.00
TP53 P04637 7/20 0.62
TSHR P16473 2/20 0.61
HSD17B10 Q99714 1/20 0.61
ALDH1A1 P00352 4/20 0.59
PDE6D O43924 1/20 0.59
ALDH2 P05091 1/20 0.59
ALDH3A1 P30838 1/20 0.59
CFTR P13569 1/20 0.58
GALR3 O60755 1/20 0.55
NR2F2 P24468 1/20 0.55
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
RAB9A P51151 1/20 0.53
KDM4E B2RXH2 1/20 0.51
CNR2 P34972 1/20 0.51

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
SCHEMBL28227656 0.87 MAPT (0.77) MAPTLMNATP53TSHRHSD17B10
SCHEMBL28261635 0.84 ALDH1A1 (0.72) MAPTLMNATP53TSHRALDH1A1
SCHEMBL30934017 0.79 MAPT (0.80) MAPTLMNATP53TSHRHSD17B10
SCHEMBL15474874 0.79 LMNA (0.65) MAPTLMNATP53TSHRALDH1A1
SCHEMBL29076181 0.79 MAPT (0.67) MAPTLMNATP53TSHRHSD17B10
SCHEMBL30581242 0.79 MAPT (0.67) MAPTLMNATP53TSHRHSD17B10
SCHEMBL26350322 0.78 LMNA (0.63) MAPTLMNATP53TSHRALDH1A1
SCHEMBL8881382 0.77 RAB9A (0.65) MAPTLMNATP53TSHRALDH1A1
SCHEMBL8305154 0.77 HDAC1 (0.71) MAPTLMNATP53ALDH1A1PDE6D
SCHEMBL8305149 0.77 HDAC1 (0.85) MAPTLMNAHDAC1HDAC8HDAC6

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
WO-2014027053-A1 BENZIMIDAZOLES FOR THE TREATMENT OF CANCER MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-02-20 WO disclosed