SCHEMBL16355253

SCHEMBL16355253

CCN(CC)c1ccc(NC(=O)c2cccc(C)c2)c(-c2cc(C(=O)N[C@H]3CCCc4ccccc43)ccn2)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
TAS1R3 Q7RTX0 4/20 0.49
TAS1R1 Q7RTX1 4/20 0.49
TAS1R2 Q8TE23 3/20 0.49
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
NPSR1 Q6W5P4 1/20 0.46
HTT P42858 1/20 0.45
TSHR P16473 1/20 0.45
CFD P00746 2/20 0.44
HPGD P15428 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 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
SCHEMBL40772 0.94 TAS1R3 (0.50) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL40121 0.94 TAS1R3 (0.50) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL15432767 0.91 TAS1R3 (0.47) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL5998996 0.91 TAS1R3 (0.47) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL6000130 0.91 TAS1R3 (0.47) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL6000345 0.90 ALDH1A1 (0.46) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL44981 0.90 ALDH1A1 (0.46) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL40208 0.89 KMT2A (0.46) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL40207 0.89 KMT2A (0.46) LMNATAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL16355238 0.89 ALDH1A1 (0.45) LMNATAS1R3TAS1R1TAS1R2KMT2A

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
US-8916569-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2014-12-23 US disclosed
US-8916569-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2014-12-23 US disclosed