SCHEMBL17580475

SCHEMBL17580475

CC(C)Oc1ccc(N2CCN(C)CC2)cc1NC=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.44
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
RAD52 P43351 1/20 0.41
CCR5 P51681 5/20 0.41
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SIRT6 Q8N6T7 2/20 0.40

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
SCHEMBL15283283 0.90 EGFR (0.42) HTR6MAPTALDH1A1TDP1RAD52
SCHEMBL17580638 0.85 LMNA (0.42) MAPTALDH1A1TDP1RAD52SIRT6
SCHEMBL29226317 0.81 PLK1 (0.48) HTR6MAPT
SCHEMBL30825044 0.81 PLK1 (0.48) HTR6MAPT
SCHEMBL15283314 0.79 ALK (0.42) HTR6MAPTALDH1A1TDP1RAD52
SCHEMBL30132248 0.77 SIRT6 (0.54) HTR6ALDH1A1RAD52NPC1POLB
SCHEMBL15283462 0.77 SIRT6 (0.54) HTR6ALDH1A1RAD52NPC1POLB
SCHEMBL17580473 0.77 GAA (0.41) HTR6MAPTRAD52CCR5POLB
SCHEMBL25699466 0.76 MAPT (0.49) HTR6MAPTALDH1A1TDP1MAPK1
SCHEMBL15283363 0.75 MAPT (0.54) HTR6MAPTALDH1A1NPC1POLB

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-2834248-B1 NOVEL THIENOPYRIMIDINE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI SA (FR) 2016-03-16 EP disclosed