SCHEMBL24196352

SCHEMBL24196352

CC(=O)N1CCN(c2ccc(F)c(N)c2C)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
CASP6 P55212 1/20 0.49
GFER P55789 1/20 0.49
NCF1 P14598 2/20 0.44
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GPR174 Q9BXC1 2/20 0.42
TP53 P04637 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 3/20 0.41
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
CLK1 P49759 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAOB P27338 1/20 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
SCHEMBL3315976 0.80 ALDH1A1 (0.60) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL10375746 0.78 GFER (0.58) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL3099621 0.78 GFER (0.58) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL3312656 0.76 ALDH1A1 (0.72) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL13419194 0.76 MAPT (0.54) ALDH1A1MAPTL3MBTL1GPR174LMNA
SCHEMBL24196221 0.75 MAPT (0.46) ALDH1A1MAPTL3MBTL1TP53USP2
SCHEMBL5988851 0.75 ALDH1A1 (0.65) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL3311256 0.74 ALDH1A1 (0.54) ALDH1A1CASP6GFERNCF1MAPT
SCHEMBL18711276 0.74 TP53 (0.56) ALDH1A1MAPTL3MBTL1GPR174TP53
SCHEMBL3314619 0.73 ALDH1A1 (0.53) ALDH1A1CASP6GFERNCF1MAPT

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-2022011274-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2022-01-13 WO disclosed