SCHEMBL20798666

SCHEMBL20798666

C[C@H]1C[C@H](F)CN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.40
DPP4 P27487 11/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
TSHR P16473 2/20 0.34
MAPT P10636 1/20 0.34
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
FAP Q12884 1/20 0.31
PEPD P12955 1/20 0.31
XPNPEP1 Q9NQW7 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
SCHEMBL13165476 0.83 DPP4 (0.39) RIPK1DPP4DPP8DPP9TSHR
SCHEMBL15099990 0.83 DPP4 (0.39) RIPK1DPP4DPP8DPP9TSHR
SCHEMBL3664998 0.81 DPP4 (0.41) RIPK1DPP4DPP8DPP9TSHR
SCHEMBL17711269 0.81 MAPT (0.33) RIPK1TSHRMAPTGAA
SCHEMBL20820011 0.78
SCHEMBL20820009 0.78
SCHEMBL17225490 0.78 DPP4 (0.46) RIPK1DPP4DPP8DPP9SMN1; SMN2
SCHEMBL20221847 0.78 DPP4 (0.38) RIPK1DPP4DPP8DPP9FAP
SCHEMBL7889534 0.76 SMN1; SMN2 (0.39) RIPK1DPP4DPP8DPP9SMN1; SMN2
SCHEMBL29942458 0.76 TSHR (0.54) TSHRMAPTGAASMN1; SMN2

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-2019049061-A1 5-(1 H-BENZO[D]IMIDAZO-2-YL)-PYRIDIN-2-AMINE AND 5-(3H-IMIDAZO[4,5-B]PYRIDIN-6-YL)-PYRIDIN-2-AMINE DERIVATIVES AS C-MYC AND P300/CBP HISTONE ACETYLTRANSFERASE INHIBITORS FOR TREATING CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-03-14 WO disclosed