SCHEMBL14044137

SCHEMBL14044137

CC(C)n1nc(CO)c(Cl)c1-c1ncccn1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MPO P05164 2/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL13683095 0.83 CA1 (0.38) MPOPOLB
SCHEMBL16200192 0.80 IDO1 (0.36) ALDH1A1L3MBTL1
SCHEMBL16200162 0.77 ALDH1A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL14139219 0.77
SCHEMBL16200177 0.66 CA1 (0.43) ALDH1A1L3MBTL1POLB
SCHEMBL16200156 0.62 RECQL (0.38)
SCHEMBL6112453 0.61 POLB (0.47) MPOPOLB
SCHEMBL19738062 0.61 ALDH1A1 (0.42) ALDH1A1L3MBTL1
SCHEMBL13683155 0.60 ADCY10 (0.36)
SCHEMBL14044161 0.60 HDAC3 (0.32)

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-7435830-B2 Bicyclic and bridged nitrogen heterocycles CHEMOCENTRYX, INC. (US) 2008-10-14 US disclosed