SCHEMBL7915448

SCHEMBL7915448

CC(C)c1ccc(CN2CCN(c3ccccc3Cl)CC2)c(=O)c(OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
DRD2 P14416 3/20 0.46
DRD4 P21917 3/20 0.46
DRD3 P35462 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PLA2G1B P04054 1/20 0.46
RAB9A P51151 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
HTR7 P34969 2/20 0.44
LMNA P02545 3/20 0.43
TSHR P16473 1/20 0.43
TP53 P04637 1/20 0.42
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL7921648 0.90 DRD4 (0.54) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL7927130 0.90 MEN1 (0.54) KDM4EDRD2DRD4DRD3ALDH1A1
SCHEMBL7915440 0.89 DRD2 (0.51) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL6139831 0.88 LMNA (0.56) MAPTDRD2DRD4DRD3ALDH1A1
SCHEMBL7924075 0.87 KDM4E (0.47) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL7927315 0.87 KDM4E (0.58) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL7921093 0.87 LMNA (0.48) MAPTDRD2DRD3ALDH1A1MEN1
SCHEMBL7924011 0.86 KDM4E (0.46) KDM4EMAPTDRD2DRD4DRD3
SCHEMBL7921965 0.86 ABCB1 (0.43) MAPTDRD2DRD4ALDH1A1MEN1
SCHEMBL7924072 0.85 LMNA (0.50) MAPTDRD4ALDH1A1MEN1KMT2A

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