SCHEMBL7921093

SCHEMBL7921093

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
TSHR P16473 3/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.47
USP2 O75604 1/20 0.47
THRB P10828 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
MAPT P10636 2/20 0.46
HTR1A P08908 1/20 0.45
HTR7 P34969 1/20 0.45
SLC2A1 P11166 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GRM5 P41594 1/20 0.44
DRD2 P14416 1/20 0.43
DRD3 P35462 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
ALOX15 P16050 1/20 0.43

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) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7923524 0.91 LMNA (0.48) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7927261 0.90 LMNA (0.48) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7927130 0.88 MEN1 (0.54) LMNATSHRALDH1A1TP53SIGMAR1
SCHEMBL7924072 0.87 LMNA (0.50) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7915448 0.87 KDM4E (0.46) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7923527 0.87 TP53 (0.47) LMNATSHRALDH1A1TP53USP2
SCHEMBL7923044 0.86 LMNA (0.57) LMNATSHRALDH1A1TP53USP2
SCHEMBL7915276 0.86 LMNA (0.53) LMNATSHRALDH1A1TP53MAPT
SCHEMBL7921974 0.85 CA12 (0.56) LMNATSHRALDH1A1TP53USP2

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