SCHEMBL28857293

SCHEMBL28857293

c1ccc(-c2ccc(-c3ccc(-c4ccccn4)s3)s2)nc1

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.95
NPC1 O15118 8/20 0.95
RAB9A P51151 8/20 0.95
MAPT P10636 5/20 0.95
GLA P06280 2/20 0.95
LMNA P02545 4/20 0.62
POLB P06746 2/20 0.62
CCR1 P32246 2/20 0.62
CCR5 P51681 2/20 0.62
CCR8 P51685 2/20 0.62
CYP1A2 P05177 1/20 0.62
METAP1 P53582 1/20 0.62
BLM P54132 1/20 0.62
HIF1A Q16665 1/20 0.62
DOHH Q9BU89 1/20 0.62
P4HTM Q9NXG6 1/20 0.62
ATM Q13315 1/20 0.58
HDAC3 O15379 1/20 0.56
HDAC4 P56524 1/20 0.56
HDAC1 Q13547 1/20 0.56

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
SCHEMBL3069800 0.97 KDM4E (1.00) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL14307217 0.89 KDM4E (0.76) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL4658811 0.87 KDM4E (0.79) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL9195015 0.86 KDM4E (0.70) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL146382 0.84 KDM4E (0.75) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL29094170 0.83 KDM4E (0.73) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL10162362 0.83 KDM4E (0.66) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL753210 0.82 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL20382465 0.82 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL21258329 0.82 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA

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-114854037-A Cobalt (II) complex with semiconductor property and preparation method thereof 宿州学院 2022-08-05 CN disclosed
CN-114854037-A Cobalt (II) complex with semiconductor property and preparation method thereof 宿州学院 2022-08-05 CN disclosed