SCHEMBL7468693

SCHEMBL7468693

CC(=O)N(c1ccc(CNC(=O)C[C@H](N)C(=O)O)cc1)n1c(=O)n(S(=O)(=O)c2ccc(Cl)cc2)c(=O)c2ccc(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 1/20 0.34
BACE1 P56817 1/20 0.34
TP53 P04637 3/20 0.34
LMNA P02545 3/20 0.34
POLB P06746 2/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
THRB P10828 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 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
SCHEMBL7466539 0.92 BACE1 (0.35) MAPTSMN1; SMN2BACE1TP53POLB
SCHEMBL7462091 0.90 TP53 (0.38) MAPTTP53LMNAGAATHRB
SCHEMBL7461905 0.83 CMA1 (0.39) MAPTSMN1; SMN2ALDH1A1LMNAPSEN1
SCHEMBL7472829 0.83 CMA1 (0.45) MAPTALDH1A1LMNAPSEN1PSEN2
SCHEMBL7472664 0.82 GAA (0.38) MAPTCA1CA2LMNAPOLB
SCHEMBL8784743 0.80 ALDH3A1 (0.43) MAPTALDH1A1BACE1LMNAGAA
SCHEMBL7471528 0.80 CMA1 (0.40) MAPTALDH1A1PSEN1PSEN2APH1B
SCHEMBL7468000 0.80 CMA1 (0.42) MAPTALDH1A1LMNAPOLBGAA
SCHEMBL7465884 0.78 AKR1C3 (0.38) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL7468094 0.77 CMA1 (0.41) MAPTCA2CA9ALDH1A1TP53

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
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed