SCHEMBL7870796

SCHEMBL7870796

Cc1cccc(C)c1N=C(Nc1c(C)cccc1C)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.57
GRIN3B O60391 2/20 0.57
GRIN1 Q05586 2/20 0.57
GRIN2A Q12879 2/20 0.57
GRIN2B Q13224 2/20 0.57
GRIN2C Q14957 2/20 0.57
GRIN3A Q8TCU5 2/20 0.57
SIGMAR1 Q99720 2/20 0.57
HSP90AA1 P07900 1/20 0.45
ATM Q13315 1/20 0.45
POLB P06746 3/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2B P41595 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL4109683 0.80 GRIN2D (0.67) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2154511 0.76 HSP90AA1 (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2154037 0.76 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12464067 0.76 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2154042 0.76 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30761897 0.74 ATM (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19663272 0.74 GRIN2D (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4138460 0.74 POLB (0.67) HSP90AA1ATMPOLBHPGDKCNK3
SCHEMBL8952178 0.74 SIGMAR1 (0.65) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18543938 0.74 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6303714-B1 NOVEL METALLOCENE POLYMERIZATION CATALYST COMPLEXES CONTAINING ATOMS OF GROUP 15 OF THE PERIODIC TABLE, E.G., (PENTAMETHYLCYCLOPENTADIENYL)(N,N'-BIS(PHENYL)BENZAMIDINATO)ZI RCONIUM DICHLORIDE JAPAN POLYOLEFINS CO., LTD. (JP) 2001-10-16 US disclosed
EP-0926166-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PREPARING POLYOLEFIN Japan Polyolefins Co., Ltd. (JP) 1999-06-30 EP disclosed