SCHEMBL10692803

SCHEMBL10692803

O=C1CCCC(c2ccc(F)cc2)N1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
HDAC6 Q9UBN7 3/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC5 Q9UQL6 1/20 0.51
TNKS O95271 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
GAA P10253 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 1/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
PTBP1 P26599 1/20 0.43
FADS1 O60427 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
THRB P10828 1/20 0.42
NR3C2 P08235 1/20 0.41

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
SCHEMBL10575026 0.94 MAPT (0.58) MAPTHDAC6HDAC1HDAC8HDAC5
SCHEMBL10574313 0.89 HDAC6 (0.56) MAPTHDAC6HDAC1HDAC8HDAC5
SCHEMBL10571602 0.86 LMNA (0.60) MAPTHDAC6HDAC1HDAC8HDAC5
SCHEMBL10571732 0.85 LMNA (0.51) HDAC6HDAC1HDAC8HDAC5SMN1; SMN2
SCHEMBL10571411 0.85 LMNA (0.51) HDAC6HDAC1HDAC8HDAC5SMN1; SMN2
SCHEMBL10523492 0.85 LMNA (0.51) HDAC6HDAC1HDAC8HDAC5SMN1; SMN2
SCHEMBL10572076 0.82 ALDH1A1 (0.54) HDAC6HDAC1HDAC8HDAC5TSHR
SCHEMBL10570931 0.82 CYP19A1 (0.46) HDAC6HDAC1HDAC8HDAC5ESR1
SCHEMBL10571455 0.79 LMNA (0.58) MAPTHDAC6HDAC1HDAC8HDAC5
SCHEMBL3739324 0.79 HDAC6 (0.54) HDAC6HDAC1HDAC8HDAC5TNKS

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-87107226-A Lactam derivatives and preparation thereof 1988-06-29 CN claimed
EP-0270093-A2 Lactam derivatives, processes for the preparation thereof, pharmaceutical compositions comprising the same, and the use of such derivatives for the manufacture of a medicament having valuable therapeutic properties TANABE SEIYAKU CO., LTD. (JP) 1988-06-08 EP claimed