SCHEMBL13683201

SCHEMBL13683201

Cc1ncn(-c2c(Cl)c(C)nn2C)n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
MAPK10 P53779 1/20 0.32
GALR3 O60755 1/20 0.30
LMNA P02545 1/20 0.30
NR2F2 P24468 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GLS O94925 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
SCHEMBL13184311 0.74 KDM4E (0.33) KDM4EADORA2AADORA2BSMN1; SMN2
SCHEMBL13184164 0.70 ADORA2A (0.36) KDM4EADORA2AADORA2BLMNASMN1; SMN2
SCHEMBL16200255 0.68 SMN1; SMN2 (0.38) KDM4EADORA2AADORA2BLMNASMN1; SMN2
SCHEMBL16200075 0.67 LMNA (0.41) KDM4ELMNAKMT2ASMN1; SMN2
SCHEMBL13184163 0.67 CYP3A4 (0.38) KDM4EADORA2AADORA2BGALR3LMNA
SCHEMBL13683097 0.64 SMN1; SMN2 (0.56) KDM4ELMNAKMT2ASMN1; SMN2
SCHEMBL16200076 0.64 CHRNB2 (0.45) KDM4ESMN1; SMN2
SCHEMBL16202027 0.64 KAT7 (0.40) MAPK10
SCHEMBL1196791 0.62
SCHEMBL1086373 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
US-7435830-B2 Bicyclic and bridged nitrogen heterocycles CHEMOCENTRYX, INC. (US) 2008-10-14 US disclosed