SCHEMBL7927261

SCHEMBL7927261

CC(C)c1ccc(CN2CCN(c3cccc(F)c3)CC2)c(=O)c(OCc2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 1/20 0.48
TP53 P04637 1/20 0.46
MAPT P10636 2/20 0.43
CRBN Q96SW2 1/20 0.42
IKZF3 Q9UKT9 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DRD2 P14416 2/20 0.40
DRD3 P35462 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
GALR3 O60755 1/20 0.39
NR2F2 P24468 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTR6 P50406 1/20 0.38

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
SCHEMBL6139831 0.92 LMNA (0.56) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7915276 0.91 LMNA (0.53) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7921093 0.90 LMNA (0.48) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7923524 0.90 LMNA (0.48) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7921905 0.89 LMNA (0.46) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7921616 0.87 LMNA (0.44) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7923296 0.87 LMNA (0.47) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7924072 0.86 LMNA (0.50) LMNAALDH1A1TSHRTP53MAPT
SCHEMBL7927130 0.85 MEN1 (0.54) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7921974 0.84 CA12 (0.56) LMNAALDH1A1TSHRTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6221868-B1 Remedies/preventives for frequent urination/urinary incontinence and tropone derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-04-24 US disclosed