SCHEMBL19993353

SCHEMBL19993353

CCN(C)CC(=O)N(C)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.45
GAA P10253 3/20 0.41
KDM4E B2RXH2 2/20 0.41
FOLH1 Q04609 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6824201 0.84 ALDH1A1 (0.42) GAAPOLBLMNAALDH1A1THRB
SCHEMBL13041524 0.82 POLQ (0.49) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL8354027 0.80 ALDH1A1 (0.39) POLQMAPTLMNAALDH1A1MEN1
SCHEMBL28746503 0.79 FOLH1 (0.49) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL8443795 0.78 POLQ (0.49) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL7506948 0.77 POLQ (0.48) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL22311426 0.77 POLQ (0.48) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL8552126 0.77 POLQ (0.48) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL13041495 0.76 POLQ (0.48) POLQGAAKDM4EFOLH1HSD17B10
SCHEMBL24232630 0.75 POLQ (0.40) POLQGAAKDM4EFOLH1HSD17B10

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-2927214-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND KYOWA HAKKO KIRIN CO LTD (JP) 2018-03-21 EP disclosed