SCHEMBL2229563

SCHEMBL2229563

CC1C2CC(CN2)N1C(=O)c1ccc(-c2ccccc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.41
HIF1A Q16665 6/20 0.41
DGAT1 O75907 3/20 0.38
USP30 Q70CQ3 2/20 0.37
CHRNA7 P36544 1/20 0.36
KCNH2 Q12809 1/20 0.36
PDE10A Q9Y233 1/20 0.35
KDM5A P29375 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL6881971 1.00 HTR2B (0.41) HTR2BHIF1ADGAT1USP30CHRNA7
SCHEMBL2227305 0.70 DGAT1 (0.35) HTR2BDGAT1USP30CHRNA7KCNH2
SCHEMBL2554720 0.65 HIF1A (0.56) HIF1AUSP30MEN1KMT2ATDP1
SCHEMBL6264166 0.65 MAPT (0.53) HIF1AUSP30MEN1KMT2ATDP1
SCHEMBL71034 0.65 HIF1A (0.55) HIF1A
SCHEMBL29929320 0.65 HIF1A (0.55) HIF1A
SCHEMBL24198723 0.64 HIF1A (0.49) HIF1ADGAT1MEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL28470042 0.63 HIF1A (0.54) HIF1A
SCHEMBL16456842 0.63 DGAT1 (0.40) HTR2BDGAT1USP30CHRNA7KCNH2
SCHEMBL6874628 0.63 USP30 (0.59) HIF1AUSP30MEN1KMT2A

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-2011091407-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLP (US) 2011-07-28 WO disclosed