SCHEMBL7927367

SCHEMBL7927367

CC(C)c1ccc(CN2CCC(C(=O)c3ccccc3)CC2)c(=O)c(OCc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.46
NPC1 O15118 4/20 0.46
HTR2A P28223 1/20 0.45
CCR3 P51677 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MGLL Q99685 1/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
CCR5 P51681 1/20 0.42
BCHE P06276 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
SCHEMBL7921789 0.91 CCR3 (0.45) HTR2ACCR3MEN1KMT2AMGLL
SCHEMBL7921581 0.89 KCNH2 (0.45) HTR2ACCR3MEN1KMT2AMGLL
SCHEMBL7921870 0.89 TACR1 (0.47) HTR2ACCR3MEN1KMT2AMGLL
SCHEMBL7927354 0.88 KCNH2 (0.49) HTR2ACCR3MEN1KMT2AMGLL
SCHEMBL7924050 0.85 MEN1 (0.50) CCR3MEN1KMT2ALMNAALDH1A1
SCHEMBL7927130 0.84 MEN1 (0.54) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL7927342 0.83 LMNA (0.49) HTR2ACCR3MEN1KMT2AMGLL
SCHEMBL6139831 0.81 LMNA (0.56) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL7924041 0.80 ATM (0.47) HTR2AMEN1KMT2ALMNAGAA
SCHEMBL7915448 0.79 KDM4E (0.46) RAB9AMEN1KMT2ALMNASMN1; SMN2

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