SCHEMBL4610481

SCHEMBL4610481

CC(C)n1nc(C(=O)O)c2c(I)cccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 15/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ HPGD P15428 1/20 0.35
▸ HCAR3 P49019 1/20 0.35
▸ HCAR2 Q8TDS4 1/20 0.35
▸ CLK1 P49759 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ DYRK1B Q9Y463 1/20 0.35
▸ HTR2A P28223 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL7342038 0.79 GABRA1 (0.39) HTR4KMT2AHTR2A
SCHEMBL7304429 0.76 HTT (0.42) HTR4KMT2AHPGDALDH1A1
SCHEMBL29805676 0.75 HTR4 (0.55) HTR4KMT2AHTR2A
SCHEMBL1832626 0.75 HTR4 (0.55) HTR4KMT2AHTR2A
Hydrochloric Acid SCHEMBL1405875 0.74 HTR4 (0.54) HTR4KMT2AHTR2A
SCHEMBL29527167 0.71 LDHA (0.39) HTR4
SCHEMBL22776609 0.71 LDHA (0.39) HTR4
SCHEMBL15635669 0.69 ELANE (0.39) HTR4KMT2AHPGDHCAR3HCAR2
SCHEMBL2600883 0.68 KDM4E (0.40) HTR4KMT2AALDH1A1GAA
SCHEMBL29614427 0.68 KDM4E (0.40) HTR4KMT2AALDH1A1GAA

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-1910340-A1 INDAZOLECARBOXAMIDE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS Pfizer, Inc. (US) 2008-04-16 — — EP disclosed
WO-2007010390-A1 INDAZOLECARBOXAMIDE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER JAPAN INC. (JP) 2007-01-25 — — WO disclosed
Send feedback