SCHEMBL6162393

SCHEMBL6162393

Brc1cn(-c2ccccn2)nc1-c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.41
LMNA P02545 3/20 0.41
CCR1 P32246 2/20 0.41
CCR5 P51681 2/20 0.41
CCR8 P51685 2/20 0.41
POLB P06746 2/20 0.41
CYP1A2 P05177 1/20 0.41
METAP1 P53582 1/20 0.41
BLM P54132 1/20 0.41
HIF1A Q16665 1/20 0.41
DOHH Q9BU89 1/20 0.41
P4HTM Q9NXG6 1/20 0.41
ALKBH2 Q6NS38 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 5/20 0.37
TP53 P04637 4/20 0.36
RAB9A P51151 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALOX15 P16050 2/20 0.36

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
SCHEMBL10521543 0.77 SMN1; SMN2 (0.40) KDM4EPOLBALKBH2EGLN1SMN1; SMN2
SCHEMBL10521880 0.72 CA2 (0.39) KDM4EPOLBALKBH2EGLN1SMN1; SMN2
SCHEMBL3463942 0.69 GRM5 (0.55) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3072397 0.68 FLT3 (0.64) KDM4ELMNACCR1CCR5CCR8
Bromide SCHEMBL6161656 0.68 GRM5 (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7152205 0.68 GRM5 (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL323086 0.68 KDM4E (0.68) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30189385 0.67 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4612674 0.67 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL5204921 0.67 GRM5 (0.46) POLBALKBH2EGLN1SMN1; SMN2RAB9A

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
EP-0770610-B1 Biospecific binding reactants labelled with luminescent lanthanide chelates and their use WALLAC OY (FI) 2005-07-06 EP disclosed
US-5859215-A IMMUNOASSAY; DNA HYBRID ANALYSIS; COMPLEXING; MEDICAL DIAGNOSIS WALLAC OY (FI) 1999-01-12 US disclosed
EP-0770610-A1 Biospecific binding reactants labelled with luminescent lanthanide chelates and their use WALLAC OY (FI) 1997-05-02 EP disclosed