SCHEMBL9324049

SCHEMBL9324049

COC(OC)c1ccc(F)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.41
MDM2 Q00987 9/20 0.40
MDM4 O15151 2/20 0.38
NR3C1 P04150 2/20 0.36
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 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
SCHEMBL15853710 0.82 NR3C2 (0.40) NR3C2MDM2MDM4NR3C1HTR2A
SCHEMBL8807188 0.79 IDO1 (0.43) SLC6A4MAPTHTT
SCHEMBL16212082 0.79 TP53 (0.55) LMNATP53HTT
SCHEMBL9684769 0.79 L3MBTL1 (0.50) NR3C2MDM2MDM4MAPTHTT
SCHEMBL20888260 0.78 MDM2 (0.40) NR3C2MDM2MDM4
SCHEMBL20564216 0.78 MAPT (0.33) NR3C2MAPTHTT
SCHEMBL420958 0.77 LMNA (0.42) NR3C2MDM2HTR2ASLC6A4KCNH2
SCHEMBL500056 0.76 APLNR (0.39)
SCHEMBL17061753 0.75 LMNA (0.41) NR3C2MDM2MDM4HTR2ASLC6A4
SCHEMBL6204193 0.75 CES2 (0.42) HTR2ASLC6A4KCNH2MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393668-B1 Method of preparation of benzaldehyde dialkyl acetals and new benzaldehyde dialkyl acetals BASF AG (DE) 1994-02-02 EP disclosed
EP-0393667-B1 PROCESS FOR THE PRODUCTION OF BENZYL METHYL ESTERS BASF Aktiengesellschaft (DE) 1993-06-23 EP disclosed
US-5078838-A By electrochemical anodic oxidation of benzyl derivatives in the presence of an aliphatic alcohol BASF AKTIENGESELLSCHAFT (DE) 1992-01-07 US disclosed
EP-0393668-A2 Method of preparation of benzaldehyde dialkyl acetals and new benzaldehyde dialkyl acetals BASF Aktiengesellschaft (DE) 1990-10-24 EP disclosed
EP-0393667-A1 Process for the production of benzyl methyl esters BASF Aktiengesellschaft (DE) 1990-10-24 EP disclosed