SCHEMBL24258262

SCHEMBL24258262

CC(F)(F)c1ccc(CN(c2ncnc(NCC3(CC(=O)NCCC(=O)O)CCOCC3)c2F)C2CC2)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.34
GIPR P48546 2/20 0.34
ADCY6 O43306 1/20 0.32
ADCY3 O60266 1/20 0.32
ADCY9 O60503 1/20 0.32
ADCY5 O95622 1/20 0.32
ADCY8 P40145 1/20 0.32
GLP1R P43220 1/20 0.32
ADCY7 P51828 1/20 0.32
ADCY2 Q08462 1/20 0.32
ADCY1 Q08828 1/20 0.32
ADCY4 Q8NFM4 1/20 0.32
RORC P51449 2/20 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
SCHEMBL19640368 0.95 GCGR (0.34) GCGRGIPRRORC
SCHEMBL24258274 0.93 RORC (0.31) GCGRRORC
SCHEMBL24258269 0.91 MKNK2 (0.34) RORC
SCHEMBL19640542 0.89 RORC (0.33) RORC
SCHEMBL17501183 0.88 CCRL2 (0.32) RORC
SCHEMBL19640653 0.87 MKNK2 (0.34) RORC
SCHEMBL19640638 0.86 RORC (0.34) RORC
SCHEMBL19640668 0.85 RORC (0.33) RORC
SCHEMBL17501303 0.85 CCRL2 (0.32) RORC
SCHEMBL19650896 0.84 CSF1R (0.32) RORC

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
EP-3177612-B1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES NUEVOLUTION AS (DK) 2022-02-23 EP disclosed