SCHEMBL7202824

SCHEMBL7202824

O=Cc1ncc(C(=O)OC(=O)c2cnc(C3OCCO3)s2)s1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.31

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
SCHEMBL7202820 0.87 RXRA (0.37) RORC
SCHEMBL2406553 0.74 HCAR2 (0.46) RORC
SCHEMBL2897171 0.72 HCAR2 (0.33) RORC
SCHEMBL17178097 0.70
SCHEMBL16742919 0.70 FFAR2 (0.45)
SCHEMBL2412676 0.66 ALDH1A1 (0.55)
SCHEMBL15321067 0.66 CDC7 (0.55)
SCHEMBL2406424 0.65 HCAR2 (0.53)
SCHEMBL24975813 0.63 HPGD (0.55)
SCHEMBL2898435 0.62 FLT3 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003076440-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS CALCITONIN AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-18 WO disclosed