SCHEMBL4469145

SCHEMBL4469145

CC(C)(C)OC(=O)N1CCCC(OCc2ccc(F)c(F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.53
BCL9 O00512 1/20 0.50
CTNNB1 P35222 1/20 0.50
PRMT5 O14744 1/20 0.48
WDR77 Q9BQA1 1/20 0.48
SIGMAR1 Q99720 6/20 0.47
TMEM97 Q5BJF2 5/20 0.47
SCN9A Q15858 1/20 0.44
TRPV3 Q8NET8 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
S1PR3 Q99500 1/20 0.43
KAT7 O95251 1/20 0.43
KAT8 Q9H7Z6 1/20 0.43
PDE4B Q07343 1/20 0.42

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
SCHEMBL16614219 0.87 DRD4 (0.53) DRD4SIGMAR1TMEM97
SCHEMBL27471148 0.84 PRMT5 (0.52) PRMT5WDR77KAT7KAT8PDE4B
SCHEMBL29136116 0.84 PRMT5 (0.50) PRMT5WDR77PDE4B
SCHEMBL6413520 0.83 DRD4 (0.53) DRD4BCL9CTNNB1SIGMAR1TMEM97
SCHEMBL29117319 0.83 PRMT5 (0.56) PRMT5WDR77KAT7KAT8
SCHEMBL12607070 0.83 PRMT5 (0.56) PRMT5WDR77KAT7KAT8
SCHEMBL12607067 0.83 PRMT5 (0.56) PRMT5WDR77KAT7KAT8
SCHEMBL2069058 0.83 MEN1 (0.48) PRMT5WDR77
SCHEMBL23839391 0.81 LIPG (0.49) PRMT5WDR77
SCHEMBL21668749 0.81 LIPG (0.49) PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494992-B2 Antiparasitic terpene alkaloids PFIZER INC. (US) 2009-02-24 US disclosed
US-20070185101-A1 Antiparasitic terpene alkaloids PFIZER PRODUCTS INC 2007-08-09 US disclosed
EP-1597264-A2 ANTIPARASITIC TERPENE ALKALOIDS Pfizer Limited (GB) 2005-11-23 EP disclosed
WO-2004072086-A2 ANTIPARASITIC TERPENE ALKALOIDS PFIZER LIMITED (GB) 2004-08-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070185101-A1 Antiparasitic terpene alkaloids CYP51A1, DHPS, CYP8B1 DRD4 185/4885BCL9 3832/4885CTNNB1 2431/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.