SCHEMBL5807285

SCHEMBL5807285

NC(=O)N(c1ccc(F)cc1)c1cccc(C(=O)N2CCN(Cc3c[nH]cn3)c3ccc(-c4ccccc4)cc3C2)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.43
FNTB P49356 7/20 0.43
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
MAPK1 P28482 1/20 0.35
DPP8 Q6V1X1 1/20 0.34
PRKAA2 P54646 2/20 0.34
SLC6A7 Q99884 2/20 0.33
GRM5 P41594 2/20 0.33
CETP P11597 1/20 0.33
FYN P06241 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3502482 0.84 FNTA (0.52) FNTAFNTBMAPK1DPP8SLC6A7
SCHEMBL3499758 0.83 FNTA (0.44) FNTAFNTBPRKAA2
SCHEMBL3501527 0.82 FNTA (0.49) FNTAFNTBCDK4CCND1DPP8
SCHEMBL3499833 0.82 FNTA (0.49) FNTAFNTBSLC6A7GRM5MEN1
SCHEMBL6634090 0.82 FNTA (0.53) FNTAFNTBMAPK1KMT2AALDH1A1
SCHEMBL3502028 0.81 FNTA (0.48) FNTAFNTBSLC6A7GRM5MEN1
SCHEMBL3497891 0.80 FNTA (0.53) FNTAFNTBCDK4CCND1ABL1
SCHEMBL3502156 0.80 FNTA (0.49) FNTAFNTBSLC6A7ABL1
SCHEMBL3499967 0.80 FNTA (0.52) FNTAFNTBMAPK1GRM5MEN1
SCHEMBL8052009 0.79 FNTA (0.45) FNTAFNTBDPP8SLC6A7GRM5

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-2005089515-A9 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES BRIGHAM & WOMENS HOSPITAL (US) 2006-01-26 WO disclosed