SCHEMBL10341808

SCHEMBL10341808

CC(C)C(Nc1ccc(C(F)(F)F)cc1Cl)C(=O)OCc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
LMNA P02545 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
TP53 P04637 1/20 0.58
POLB P06746 1/20 0.58
GAA P10253 1/20 0.58
TSHR P16473 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
MRGPRX4 Q96LA9 10/20 0.43
ALDH1A1 P00352 2/20 0.43
PDE2A O00408 1/20 0.38
MAPK1 P28482 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL10341841 0.95 MAPT (0.58) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10341988 0.95 KMT2A (0.55) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10341800 0.95 MAPT (0.55) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10341875 0.93 MAPT (0.54) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10341877 0.92 LMNA (0.53) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10341812 0.91 MAPT (0.52) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10955599 0.85 MAPT (0.66) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10342259 0.84 MAPT (0.46) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL11433007 0.84 MAPT (0.60) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10868003 0.82 MAPT (0.45) MAPTLMNANPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181284-B1 AMINO ACID ESTERS SANDOZ AG (CH) 1990-02-07 EP claimed
EP-0181284-A1 Amino acid esters SANDOZ AG (CH) 1986-05-14 EP claimed
EP-0181284-B1 AMINO ACID ESTERS SANDOZ AG (CH) 1990-02-07 EP disclosed
EP-0181284-A1 Amino acid esters SANDOZ AG (CH) 1986-05-14 EP disclosed