SCHEMBL15432604

SCHEMBL15432604

CS(=O)(=O)OCCC#Cc1cccc(C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
SLC7A11 Q9UPY5 1/20 0.40
FFAR1 O14842 2/20 0.38
HAO1 Q9UJM8 1/20 0.38
SLC16A3 O15427 1/20 0.38
NR1H2 P55055 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
MRGPRX4 Q96LA9 3/20 0.37
TP53 P04637 2/20 0.37
PKM P14618 2/20 0.37
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
RAB9A P51151 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NPC1 O15118 2/20 0.36
PLA2G4B P0C869 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL45751 0.81 KMT2A (0.42) KMT2AHAO1SMN1; SMN2MRGPRX4TP53
SCHEMBL16799926 0.80 POLB (0.45) RAB9A
SCHEMBL46622 0.78 ASIC3 (0.48) KMT2ASLC7A11HAO1
SCHEMBL18021008 0.78 KDM4D (0.43) KMT2ASLC7A11SLC16A3SMN1; SMN2RAB9A
SCHEMBL16799962 0.77 NPC1 (0.39) KMT2ASLC7A11FFAR1HAO1SLC16A3
SCHEMBL46986 0.76 CHRNB2 (0.49) KMT2ASLC7A11SMN1; SMN2RAB9ANPC1
SCHEMBL18059157 0.76 CHRNB2 (0.49) KMT2ASLC7A11HAO1SLC16A3SMN1; SMN2
SCHEMBL16799806 0.75 NPC1 (0.39) KMT2ASLC7A11FFAR1HAO1SLC16A3
SCHEMBL16799961 0.74 NPC1 (0.41) KMT2ASLC7A11SLC16A3SMN1; SMN2RAB9A
SCHEMBL23015043 0.74 ALDH1A1 (0.46) FFAR1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590656-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2017-11-15 EP disclosed
US-20170037010-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2017-02-09 US disclosed
US-20170037010-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2017-02-09 US disclosed
EP-2591354-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2016-09-07 EP disclosed
US-9301951-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2016-04-05 US disclosed
US-9301951-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2016-04-05 US disclosed
US-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2015-06-18 US disclosed
US-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2015-06-18 US disclosed
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
US-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2014-01-23 US disclosed
US-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2014-01-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A2, SLC34A1, SLC10A2 KMT2A 4695/4885SLC7A11 289/4885FFAR1 1628/4885
US-20170037010-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A2, SLC34A1, SLC10A2 KMT2A 4695/4885SLC7A11 289/4885FFAR1 1628/4885
US-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC10A2, SLC34A2, SLC34A3 KMT2A 4830/4885SLC7A11 255/4885FFAR1 3354/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.