SCHEMBL27948873

SCHEMBL27948873

CCNC(CC)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.61
KIF11 P52732 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
MAPK1 P28482 1/20 0.34
NR3C2 P08235 1/20 0.34
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 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
SCHEMBL28312942 0.83 KCNN4 (0.57) KCNN4KIF11TAAR1LMNAHTT
SCHEMBL28778295 0.79 CYP2C19 (0.46) KCNN4KIF11LMNAHTTL3MBTL1
SCHEMBL13171304 0.79 KIF11 (0.60) KCNN4KIF11TAAR1
SCHEMBL9318575 0.79 KCNN4 (0.44) KCNN4KIF11TAAR1LMNAKDM4E
SCHEMBL2272802 0.79 KCNN4 (0.53) KCNN4KIF11TAAR1MAPK1NR3C2
SCHEMBL19027907 0.77 KCNN4 (0.61) KCNN4KIF11TAAR1MAPK1NR3C2
SCHEMBL28262161 0.77 KCNN4 (0.45) KCNN4KIF11TAAR1MAPK1NR3C2
SCHEMBL9318004 0.77 KCNN4 (0.41) KCNN4KIF11TAAR1NR3C2LMNA
SCHEMBL11805262 0.76 KCNN4 (0.67) KCNN4KIF11TAAR1MAPK1NR3C2
SCHEMBL2490805 0.76 KCNN4 (1.00) KCNN4KIF11TAAR1MAPK1NR3C2

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
CN-103508898-A Novel preparation method of alverine citrate HEBEI KINGSCI PHARMACEUTICAL TECHNOLOGY CO LTD 2014-01-15 CN disclosed