SCHEMBL28409273

SCHEMBL28409273

O=c1ccc2ccccc2n1-c1ccccc1.O=c1ccc2ccccc2n1-c1ccccc1.O=c1ccc2ccccc2n1-c1ccccc1.[Ir]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
BRD4 O60885 1/20 0.52
BRPF1 P55201 1/20 0.52
CA9 Q16790 1/20 0.52
KAT2B Q92831 1/20 0.52
BRD9 Q9H8M2 1/20 0.52
ALDH1A1 P00352 2/20 0.49
TSHR P16473 2/20 0.49
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GSK3A P49840 3/20 0.42
GSK3B P49841 3/20 0.42
GAA P10253 1/20 0.42
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
CCND2 P30279 1/20 0.42
CCND3 P30281 1/20 0.42
MAPK1 P28482 2/20 0.41
PGR P06401 1/20 0.40

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
SCHEMBL28412720 1.00 CA12 (0.52) CA12BRD4BRPF1CA9KAT2B
SCHEMBL29941621 0.98 CA12 (0.53) CA12BRD4BRPF1CA9KAT2B
SCHEMBL3046549 0.98 CA12 (0.53) CA12BRD4BRPF1CA9KAT2B
SCHEMBL8040091 0.83 CA12 (0.52) CA12BRD4BRPF1CA9KAT2B
SCHEMBL7293263 0.83 BRPF1 (0.47) CA12BRD4BRPF1CA9KAT2B
SCHEMBL11693860 0.79 LMNA (0.53) CA12BRD4BRPF1CA9KAT2B
SCHEMBL7286251 0.78 SCN2A (0.47) CA12BRD4BRPF1CA9KAT2B
SCHEMBL17505192 0.77 BRPF1 (0.56) BRPF1ALDH1A1TSHRKDM4EL3MBTL1
SCHEMBL9159347 0.77 ALDH1A1 (0.46) ALDH1A1TSHRKDM4EGAAMAPK1
SCHEMBL140196 0.77 ALDH1A1 (0.42) ALDH1A1TSHRL3MBTL1GSK3AGSK3B

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-107046018-B Glass substrate package and method of manufacturing the same 杨秉荣 2020-06-02 CN disclosed