SCHEMBL46948

SCHEMBL46948

Bc1cccc(C(=O)Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
ACMSD Q8TDX5 1/20 0.43
POLB P06746 1/20 0.38
ALDH1A1 P00352 3/20 0.37
CYP1A2 P05177 1/20 0.34
GRM5 P41594 1/20 0.34
TERT O14746 4/20 0.33
GAA P10253 3/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
MCL1 Q07820 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
SCHEMBL321127 0.84 KDM4E (0.59) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL11943009 0.80 KDM4E (0.70) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL12778628 0.78 ALDH1A1 (0.47) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL3044752 0.76 KDM4E (0.44) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL1766284 0.76 TSHR (0.45) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL27643814 0.76 KDM4E (0.77) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL12374823 0.75 TERT (0.57) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL3956769 0.74 GRM4 (0.45) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL31197987 0.74 GRM4 (0.45) KDM4ETDP1TSHRALOX15ACMSD
SCHEMBL13086225 0.74 KDM4E (0.48) KDM4ETDP1TSHRALOX15ACMSD

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-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed