SCHEMBL12425852

SCHEMBL12425852

CCC1CCN(Cc2cc(C)on2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
RECQL P46063 1/20 0.42
TLR9 Q9NR96 3/20 0.41
TLR8 Q9NR97 3/20 0.41
TLR7 Q9NYK1 3/20 0.41
PRKAA2 P54646 1/20 0.39
NMT1 P30419 2/20 0.39
AURKA O14965 6/20 0.38
KDM4E B2RXH2 1/20 0.38
KCNH2 Q12809 2/20 0.37
AURKB Q96GD4 1/20 0.37
AURKC Q9UQB9 1/20 0.37
FLT3 P36888 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL14375262 0.84 KDM4E (0.51) MAPTRECQLTLR9TLR8TLR7
SCHEMBL21101179 0.81 PRKAA2 (0.41) MAPTRECQLTLR9TLR8TLR7
SCHEMBL20328913 0.80 EGFR (0.52) MAPTRECQLAURKAKDM4EKCNH2
SCHEMBL12384858 0.80 MAPT (0.41) MAPTRECQLTLR9TLR8TLR7
SCHEMBL18932538 0.80 MAPT (0.41) MAPTRECQLTLR9TLR8TLR7
SCHEMBL18932537 0.78 KDM4E (0.48) MAPTRECQLAURKAKDM4EKCNH2
SCHEMBL15214318 0.78 L3MBTL1 (0.46) MAPTRECQLTLR9TLR8TLR7
SCHEMBL15468520 0.78 TLR9 (0.41) MAPTRECQLTLR9TLR8TLR7
SCHEMBL12424320 0.77 TLR9 (0.38) MAPTRECQLTLR9TLR8TLR7
SCHEMBL2004023 0.77 MAPT (0.46) MAPTRECQLTLR9TLR8TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 US disclosed
US-20110098272-A1 Novel Compounds As Casein Kinase Inhibitors PFIZER INC 2011-04-28 US 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 (2 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 MAPT 4361/4885RECQL 112/4885TLR9 2536/4885
US-20110098272-A1 Novel Compounds As Casein Kinase Inhibitors CSNK1A1, CSNK1A1L, CSNK1G1 MAPT 808/4885RECQL 2843/4885TLR9 4865/4885

“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.