SCHEMBL29095975

SCHEMBL29095975

[SiH3]Oc1cccnc1-c1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.48
LMNA P02545 4/20 0.48
CCR1 P32246 3/20 0.48
CCR5 P51681 3/20 0.48
CCR8 P51685 3/20 0.48
POLB P06746 2/20 0.48
CYP1A2 P05177 1/20 0.48
METAP1 P53582 1/20 0.48
BLM P54132 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
NPC1 O15118 7/20 0.42
SMN1; SMN2 Q16637 6/20 0.42
TP53 P04637 5/20 0.42
RAB9A P51151 5/20 0.42
HTT P42858 4/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
ALOX15 P16050 2/20 0.42

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
SCHEMBL29798862 1.00 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7037994 0.81 SMN1; SMN2 (0.51) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30867783 0.81 SMN1; SMN2 (0.51) KDM4ELMNACCR1CCR5CCR8
SCHEMBL20668222 0.81 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL27948891 0.78 LMNA (0.46) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4138237 0.75 KDM4E (0.56) KDM4ELMNACCR1CCR5CCR8
SCHEMBL31692089 0.75 KDM4E (0.56) KDM4ELMNACCR1CCR5CCR8
SCHEMBL176039 0.74 KDM4E (0.68) KDM4ELMNACCR1CCR5CCR8
Hydrochloric Acid SCHEMBL29006017 0.74 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30031 0.71 KDM4E (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111247156-B Aromatic aminosilicone functional material for capping porous dielectrics 默克专利股份有限公司 2023-10-27 CN disclosed