SCHEMBL2186145

SCHEMBL2186145

O=C(Nc1cc(F)cc2c1OCCO2)N1CCC(c2nc(C(=O)N3CCN(c4cccc(C(F)(F)F)c4)CC3)cs2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.44
HTT P42858 6/20 0.44
SMN1; SMN2 Q16637 6/20 0.44
MAPT P10636 6/20 0.44
MAPK1 P28482 3/20 0.44
TSHR P16473 4/20 0.43
HSD17B10 Q99714 3/20 0.43
POLB P06746 3/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RECQL P46063 1/20 0.40
GAA P10253 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
SCHEMBL2186921 0.86 MAPT (0.62) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2188261 0.84 LMNA (0.56) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2188122 0.83 LMNA (0.55) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2185757 0.82 LMNA (0.66) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL27698610 0.82 LMNA (0.48) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2186886 0.82 LMNA (0.47) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2187357 0.81 LMNA (0.57) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2187717 0.80 LMNA (0.53) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2189156 0.79 HSD17B10 (0.52) LMNAHTTSMN1; SMN2MAPTMAPK1
SCHEMBL2186962 0.79 LMNA (0.56) LMNAHTTSMN1; SMN2MAPTMAPK1

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-2343293-A1 NOVEL PIPERIDIN-4-YL-THIAZOLE-CARBOXAMIDE ANALOGUES AS INHIBITORS OF T-CELL PROLIFERATION AND USES THEREOF 4SC AG (DE) 2011-07-13 EP disclosed