SCHEMBL9788432

SCHEMBL9788432

CCOC(=O)C(F)Sc1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 4/20 0.44
HTT P42858 2/20 0.44
POLB P06746 2/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 6/20 0.43
MEN1 O00255 4/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 2/20 0.43
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
ATM Q13315 1/20 0.41
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
AURKA O14965 1/20 0.39
NTRK1 P04629 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL11748824 0.88 CA12 (0.47) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL12437771 0.87 TSHR (0.48) ALDH1A1MAPTHTTKMT2AMEN1
SCHEMBL10817048 0.86 MEN1 (0.50) ALDH1A1MAPTPOLBKMT2AMEN1
SCHEMBL15083665 0.81 HPGD (0.55) ALDH1A1MAPTHTTPOLBRECQL
SCHEMBL4651705 0.81 MAPT (0.45) ALDH1A1MAPTHTTPOLBRECQL
SCHEMBL20913027 0.76 HTT (0.42) ALDH1A1MAPTHTTPOLBRECQL
SCHEMBL28092062 0.71 CA12 (0.56) ALDH1A1MAPTHTTRECQLKMT2A
SCHEMBL17224784 0.71 HPGD (0.52) ALDH1A1MAPTHTTPOLBRECQL
SCHEMBL23086283 0.70 MEN1 (0.44) ALDH1A1HTTKMT2AMEN1HPGD
SCHEMBL5685986 0.70 CA12 (0.50) ALDH1A1MAPTKMT2ALMNAGAA

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
JP-3284662-A None JP disclosed
JP-H03284662-A ALPHA-MONOFLUOROSULFIDE AND PRODUCTION THEREOF ASAHI GLASS CO LTD 1991-12-16 JP disclosed