SCHEMBL46593

SCHEMBL46593

Cc1ccc(-c2cnc(NC(=O)c3cc(N4CCCCC4)ccc3NC(=O)c3cccc(C(=O)NCCOCCO)c3)nc2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.42
AXL P30530 1/20 0.37
MERTK Q12866 1/20 0.37
SLC34A2 O95436 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
PRKD1 Q15139 2/20 0.35
MAPK14 Q16539 3/20 0.35
LCK P06239 2/20 0.35
KDR P35968 2/20 0.35
RET P07949 1/20 0.35
PDGFRA P16234 1/20 0.35
MAPK9 P45984 1/20 0.35
CDK8 P49336 1/20 0.35
PKN2 Q16513 1/20 0.35
LRRK2 Q5S007 1/20 0.35

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
SCHEMBL18059199 0.89 AXL (0.34) F10AXLMERTKSLC34A2MEN1
SCHEMBL10148516 0.88 F10 (0.44) F10PRKD1
SCHEMBL15444420 0.88 F10 (0.41) F10MAPK14LCKKDRMAPK9
SCHEMBL46915 0.80 KIF18A (0.41) F10SLC34A2MEN1NPC1RAB9A
SCHEMBL46908 0.78 F10 (0.42) F10AXLMERTKMAPK14LCK
SCHEMBL46972 0.77 F10 (0.41) F10AXLMERTKMAPK14LCK
SCHEMBL40315 0.77 F10 (0.39) F10AXLMERTKMAPK14LCK
SCHEMBL46895 0.76 F10 (0.43) F10LCK
SCHEMBL10225990 0.74 USP30 (0.41) F10MAPK14LCKRETPDGFRA
SCHEMBL40407 0.74 IP6K1 (0.46) AXLMERTKNPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590965-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2016-04-20 EP disclosed
US-9289429-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2016-03-22 US disclosed
US-20150157637-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2015-06-11 US disclosed
US-8809339-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2014-08-19 US disclosed
US-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2014-01-23 US disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO 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 (2 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-20150157637-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC10A2, SLC34A2, SLC34A1 F10 1711/4885AXL 3500/4885MERTK 3635/4885
US-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC10A2, SLC34A2, SLC34A3 F10 1866/4885AXL 4371/4885MERTK 4055/4885

“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.