SCHEMBL40194

SCHEMBL40194

C#CCOCCOCCOCCOCCOCCOCCC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL22199369 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL19228952 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL19228957 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL19228949 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL10089720 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL10138522 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL10101994 1.00 TSHR (0.40) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL935503 0.95
SCHEMBL26205670 0.90 TSHR (0.47) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL22589673 0.86 TSHR (0.48) TSHRMEN1KMT2AALDH1A1HSD17B10

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
EP-2591354-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT Ardelyx, Inc. (US) 2013-05-15 EP disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed