SCHEMBL27604192

SCHEMBL27604192

CC(=O)C1(F)C=CC(c2ccccc2)=CC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RECQL P46063 1/20 0.32

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
SCHEMBL3947332 0.87 THRB (0.31)
SCHEMBL5479512 0.81 MAPT (0.35) MAPTSMN1; SMN2RECQL
SCHEMBL8486887 0.78 MAPT (0.33) MAPTSMN1; SMN2
SCHEMBL6808145 0.78 MAPT (0.33) MAPTSMN1; SMN2
SCHEMBL27723193 0.78 BACE1 (0.31) MAPTSMN1; SMN2
Acetone SCHEMBL28895836 0.76 MAPT (0.38) MAPTSMN1; SMN2
SCHEMBL28572651 0.76 ALDH1A1 (0.34) MAPTSMN1; SMN2RECQL
SCHEMBL6903846 0.76 SMN1; SMN2 (0.32) MAPTSMN1; SMN2
SCHEMBL28005333 0.76 DHODH (0.32) MAPTSMN1; SMN2
SCHEMBL7455053 0.76

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
CN-100528329-C Microencapsulated catalysts, methods of their preparation and methods of use AVECIA LTD (GB) 2009-08-19 CN disclosed
CN-1525881-A Microencapsulated catalysts, methods of their preparation and methods of use 2004-09-01 CN disclosed