Sugi Predict

Sugi Predict / Compounds / SCHEMBL16208024

SCHEMBL16208024

SCHEMBL16208024

O=C(NC1[C@@H]2CC3C[C@H]1CC(O)(C3)C2)ON1CCN(c2ccc(-c3ccc(OCC(F)(F)F)cn3)cc2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 18/20 0.47
▸ TYRO3 Q06418 2/20 0.39

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
SCHEMBL16208096 0.91 HSD11B1 (0.48) HSD11B1
SCHEMBL16208051 0.89 HSD11B1 (0.51) HSD11B1
SCHEMBL16208175 0.89 HSD11B1 (0.48) HSD11B1
SCHEMBL973402 0.89 HSD11B1 (0.60) HSD11B1TYRO3
SCHEMBL16208017 0.86 HSD11B1 (0.47) HSD11B1
SCHEMBL16208000 0.85 HSD11B1 (0.46) HSD11B1TYRO3
SCHEMBL16207933 0.82 HSD11B1 (0.56) HSD11B1TYRO3
SCHEMBL16208070 0.80 HSD11B1 (0.49) HSD11B1
SCHEMBL973830 0.80 HSD11B1 (0.62) HSD11B1
SCHEMBL16208037 0.80 HSD11B1 (0.58) HSD11B1

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-2238126-B1 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2014-11-05 — — EP claimed