SCHEMBL12423938

SCHEMBL12423938

OCc1c(C2CCOCC2)nc2c(c1I)C(O)CC1(CCC1)C2

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 19/20 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
SCHEMBL663815 1.00 CETP (0.42) CETP
SCHEMBL10238138 0.87 CETP (0.42) CETP
SCHEMBL16258484 0.87 CETP (0.42) CETP
SCHEMBL662322 0.84 CETP (0.48) CETP
SCHEMBL663738 0.82 CETP (0.41) CETP
SCHEMBL12423992 0.82 CETP (0.41) CETP
SCHEMBL10238048 0.78 CETP (0.45) CETP
SCHEMBL12423449 0.78 CETP (0.45) CETP
SCHEMBL12423446 0.75 CETP (0.43) CETP
SCHEMBL665807 0.75 CETP (0.43) CETP

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
WO-2011101424-A1 TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-25 WO disclosed