SCHEMBL14646913

SCHEMBL14646913

Cc1ccnc(-n2cnc(CN)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 2/20 0.46
▸ LOXL2 Q9Y4K0 2/20 0.41
▸ CCR1 P32246 1/20 0.40
▸ CCR5 P51681 1/20 0.40
▸ CCR8 P51685 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NOS3 P29474 1/20 0.38
▸ NOS1 P29475 1/20 0.38
▸ NOS2 P35228 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GRIN1 Q05586 2/20 0.37
▸ GRIN2B Q13224 2/20 0.37
▸ RXRA P19793 1/20 0.37
▸ CPB1 P15086 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ UHRF1 Q96T88 1/20 0.36
▸ GRIN2D O15399 1/20 0.35
▸ GRIN3B O60391 1/20 0.35

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
SCHEMBL14481089 0.80 CPB2 (0.47) CPB2CCR1CCR5CCR8KDM4E
SCHEMBL17632169 0.79 KDM4E (0.50) CPB2LOXL2CCR1CCR5CCR8
SCHEMBL30513290 0.79 KDM4E (0.50) CPB2LOXL2CCR1CCR5CCR8
SCHEMBL21425513 0.78 UHRF1 (0.47) CPB2CCR1CCR5CCR8KDM4E
SCHEMBL30030741 0.78 UHRF1 (0.47) CPB2CCR1CCR5CCR8KDM4E
SCHEMBL14551585 0.76 CPB2 (0.43) CPB2KDM4EMEN1KMT2AGRIN1
SCHEMBL30083563 0.76 CPB2 (0.53) CPB2CPB1ALDH1A1SMN1; SMN2
SCHEMBL14646909 0.72 KDM4E (0.55) CPB2KDM4EMEN1KMT2ACPB1
SCHEMBL7833391 0.72 PLAU (0.58) CPB2CCR1CCR5CCR8KDM4E
SCHEMBL318010 0.72 — —

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
EP-2548872-A1 CYCLOPROPANECARBOXYLIC ACID DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-01-23 — — EP disclosed
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