SCHEMBL11469736

SCHEMBL11469736

CC1=CC(S(=O)(=O)c2ccccc2)CCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
ALDH1A1 P00352 5/20 0.42
ACHE P22303 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
HTR6 P50406 3/20 0.36
CYP2C9 P11712 1/20 0.36
HTR2A P28223 2/20 0.36
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HTR2C P28335 1/20 0.34
KCNH2 Q12809 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL30015657 0.74 BRD4 (0.43) MAPTALDH1A1
SCHEMBL31058537 0.71 ALDH1A1 (0.40) MAPTALDH1A1ACHEKDM4EKMT2A
SCHEMBL27891264 0.70 MAPT (0.49) MAPTALDH1A1ACHEKDM4EMEN1
SCHEMBL2316644 0.69 MAPT (0.44) MAPTALDH1A1ACHEKDM4EMEN1
SCHEMBL17192666 0.66 HTR6 (0.44) MAPTALDH1A1HTR6CYP2C9HTR2A
SCHEMBL777971 0.66 MAPT (0.56) MAPTALDH1A1ACHEKDM4EMEN1
SCHEMBL7541817 0.66 HTR2A (0.56) MAPTALDH1A1ACHEKDM4EMEN1
SCHEMBL3392609 0.66 MAPT (0.55) MAPTALDH1A1ACHEKDM4EMEN1
SCHEMBL2048495 0.65 HTR2A (0.59) MAPTALDH1A1HTR6HTR2AHTR2C
SCHEMBL776895 0.65 MAPT (0.55) MAPTALDH1A1ACHEKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4206140-A INSECTICIDES, ANTHELMINTICS ROUSSEL UCLAF (FR) 1980-06-03 US disclosed
US-4101574-A Cyclopropanecarboxylic acid chlorides ROUSSEL UCLAF (FR) 1978-07-18 US disclosed
US-3997586-A Cyclopropanecarboxylic acids and esters ROUSSEL-UCLAF (FR) 1976-12-14 US disclosed