SCHEMBL18647490

SCHEMBL18647490

CCCCCCCCCCCCCCCC(C)c1ccc(Cl)cc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
EPHX2 P34913 1/20 0.37
PSEN1 P49768 2/20 0.36
PSEN2 P49810 2/20 0.36
APH1B Q8WW43 2/20 0.36
NCSTN Q92542 2/20 0.36
APH1A Q96BI3 2/20 0.36
PSENEN Q9NZ42 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
GRM2 Q14416 1/20 0.35
EPHX1 P07099 3/20 0.35
GPR84 Q9NQS5 1/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL23084281 0.86 LMNA (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9593487 0.85 LMNA (0.49) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL19464670 0.81 MAPT (0.38) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL18704817 0.81 TP53 (0.42) MAPTLMNATP53HTTGPR84
SCHEMBL14640349 0.80 MAPT (0.42) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL18928638 0.79 HTT (0.42) MAPTLMNATP53HTTGAA
SCHEMBL9593590 0.78 LMNA (0.52) MAPTLMNATP53HTTCNR1
SCHEMBL22350765 0.77 MAPT (0.40) MAPTEPHX2PSEN1PSEN2APH1B
SCHEMBL23251395 0.77 CNR1 (0.37) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL3083071 0.76 MEN1 (0.40) TP53GPR84

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
US-9598367-B2 Heterocyclic compounds as bromodomain inhibitors ZENITH EPIGENETICS LTD. (CA) 2017-03-21 US disclosed