SCHEMBL30757485

SCHEMBL30757485

Brc1c2ccccc2c(-c2ccccn2)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
LMNA P02545 4/20 0.54
CCR1 P32246 3/20 0.54
CCR5 P51681 3/20 0.54
CCR8 P51685 3/20 0.54
METAP1 P53582 2/20 0.54
HIF1A Q16665 2/20 0.54
CYP1A2 P05177 1/20 0.54
POLB P06746 1/20 0.54
BLM P54132 1/20 0.54
DOHH Q9BU89 1/20 0.54
P4HTM Q9NXG6 1/20 0.54
NPC1 O15118 6/20 0.46
RAB9A P51151 5/20 0.46
TP53 P04637 4/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
ALOX15 P16050 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 3/20 0.46
TDP1 Q9NUW8 2/20 0.46

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
SCHEMBL20954073 1.00 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL17008146 0.89 KDM4E (0.68) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29769628 0.89 KDM4E (0.68) KDM4ELMNACCR1CCR5CCR8
SCHEMBL15835178 0.87 KDM4E (0.45) KDM4ELMNACCR1CCR5CCR8
SCHEMBL12262358 0.82 HPGDS (0.46) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30616314 0.80 METAP2 (0.39) KDM4ENPC1RAB9AL3MBTL1HSP90AA1
SCHEMBL19763002 0.80 METAP2 (0.39) KDM4ENPC1RAB9AL3MBTL1HSP90AA1
SCHEMBL19763004 0.80 KDM4E (0.36) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30616317 0.80 KDM4E (0.36) KDM4ELMNACCR1CCR5CCR8
SCHEMBL12626765 0.79 KDM4E (0.45) KDM4ELMNACCR1CCR5CCR8

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
CN-118102838-A Triazine compound and organic semiconductor layer comprising the same 诺瓦尔德股份有限公司 2024-05-28 CN disclosed
CN-111448188-B Triazine compound and organic semiconductor layer comprising the same 诺瓦尔德股份有限公司 2024-02-13 CN disclosed