SCHEMBL10274601

SCHEMBL10274601

Cc1ccc(Cl)cc1C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.51
NPY5R Q15761 4/20 0.49
LMNA P02545 1/20 0.49
TRPA1 O75762 1/20 0.48
SLC2A1 P11166 1/20 0.47
P2RX1 P51575 1/20 0.47
P2RX4 Q99571 1/20 0.47
P2RX7 Q99572 1/20 0.47
TMPRSS4 Q9NRS4 1/20 0.47
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
USP36 Q9P275 1/20 0.45
CCR1 P32246 2/20 0.44
NPC1 O15118 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL45338 0.88 KDM1A (0.51) KDM1ANPY5RLMNATRPA1SLC2A1
SCHEMBL44763 0.85 KDM1A (0.48) KDM1ANPY5RLMNATRPA1SLC2A1
SCHEMBL46584 0.80 HSPH1 (0.47) KDM1ALMNATRPA1MEN1CYP1A2
SCHEMBL16780930 0.79 LMNA (0.60) LMNATRPA1MEN1CYP1A2CYP3A4
SCHEMBL28121166 0.77 MAPT (0.47) KDM1ANPY5RLMNATRPA1MEN1
SCHEMBL44915 0.75 LMNA (0.47) LMNACYP1A2CYP3A4MAPTUSP36
SCHEMBL28551802 0.74 TRPA1 (0.45) KDM1ANPY5RTRPA1MEN1CYP1A2
SCHEMBL46946 0.74 HSPH1 (0.49) KDM1ALMNATRPA1MEN1CYP1A2
SCHEMBL16817168 0.74 SLC34A2 (0.42) KDM1ANPY5RLMNATRPA1MEN1
SCHEMBL15444454 0.73 HSPH1 (0.44) KDM1ALMNATRPA1MEN1CYP1A2

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