SCHEMBL27488131

SCHEMBL27488131

CCCCCC(Cl)(c1ccc(F)cc1)c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.40
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
MLNR O43193 1/20 0.35
NR1I2 O75469 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
TBXA2R P21731 1/20 0.35
CCKBR P32239 1/20 0.35
OPRK1 P41145 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
GAA P10253 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR3C1 P04150 1/20 0.32
CYP19A1 P11511 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL19059646 0.74 SMN1; SMN2 (0.35) KCNN4CNR1CNR2GAAL3MBTL1
SCHEMBL27641579 0.73 TSHR (0.41) KCNN4GAAMEN1KMT2AHSP90AA1
SCHEMBL26053254 0.73 SMN1; SMN2 (0.36) CNR1CNR2GAAMEN1KMT2A
SCHEMBL19965676 0.72 CNR2 (0.40) CNR1CNR2GAAPSMD14HSP90AA1
SCHEMBL4284381 0.71 ESR1 (0.38) KCNN4GAASMN1; SMN2CACNA1GHTR7
SCHEMBL22435799 0.71 CNR2 (0.41) CNR1CNR2MEN1KMT2ASMN1; SMN2
SCHEMBL20097921 0.71 CNR2 (0.42) CNR1CNR2GAAPSMD14HSP90AA1
Ammonia Solution, Strong SCHEMBL11757631 0.71 HSP90AA1 (0.40) CNR1CNR2GAAMEN1KMT2A
SCHEMBL21339358 0.70 SMN1; SMN2 (0.35) CNR1CNR2GAAMEN1KMT2A
SCHEMBL30526183 0.70 HSP90AA1 (0.42) KCNN4CNR1CNR2GAASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1193748-C Gardos channel antagonists ICAGEN INC (US) 2005-03-23 CN disclosed
CN-1344158-A Gardos channel antagonists ICAGEN INC (US) 2002-04-10 CN disclosed