SCHEMBL19657607

SCHEMBL19657607

Cc1ccc2c(n1)NCN2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.36
RAB9A P51151 1/20 0.36
CCR5 P51681 1/20 0.36
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
UHRF1 Q96T88 1/20 0.32
CYP1A2 P05177 2/20 0.31
CCR8 P51685 1/20 0.30

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
SCHEMBL20153299 0.83 UHRF1 (0.40) CCR1RAB9ACCR5GAAKMT2A
SCHEMBL19657739 0.74 HTR3A (0.33)
SCHEMBL12680341 0.71 XIAP (0.38)
SCHEMBL12680350 0.71 XIAP (0.50) RAB9AKMT2A
SCHEMBL14643852 0.68 UHRF1 (0.34) UHRF1
SCHEMBL18865507 0.68 PDK2 (0.32)
SCHEMBL13400071 0.64 CCR1 (0.34) CCR1RAB9ACCR5GAAKMT2A
SCHEMBL7920476 0.64 CCR1 (0.34) CCR1RAB9ACCR5GAAKMT2A
SCHEMBL279310 0.64 UHRF1 (0.43) CCR1RAB9ACCR5UHRF1
SCHEMBL24046845 0.63 GRM5 (0.33) CCR1RAB9ACCR5GAAKMT2A

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-2017205536-A2 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed