SCHEMBL14367236

SCHEMBL14367236

C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)O[C@@H]1C(=O)Nc2cc(F)ccc2C[C@@H]1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 15/20 0.41
PSEN2 P49810 15/20 0.41
APH1B Q8WW43 15/20 0.41
NCSTN Q92542 15/20 0.41
APH1A Q96BI3 15/20 0.41
PSENEN Q9NZ42 15/20 0.41
GSAP A4D1B5 1/20 0.37
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL3345083 0.85 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3342859 0.78 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3340914 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL14260855 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL14367226 0.74 MEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3345084 0.73 ALDH1A1 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5227301 0.73 KDM1A (0.46) ALDH1A1
SCHEMBL14260860 0.72 ALDH1A1 (0.53) ALDH1A1KDM4ETP53POLB
SCHEMBL4988269 0.72 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3343553 0.71 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7294622-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2007-11-13 US disclosed
US-7294622-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2007-11-13 US disclosed