SCHEMBL29137475

SCHEMBL29137475

Cc1ccc([N+](=O)[O-])c(C[SiH3])c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.60
CYP3A4 P08684 1/20 0.60
KAT2B Q92831 3/20 0.44
MEN1 O00255 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
ACHE P22303 3/20 0.42
GPR35 Q9HC97 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.39
S1PR4 O95977 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL7193090 0.85 TSHR (0.64) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL27599498 0.83 TSHR (0.62) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL67997 0.81 TSHR (0.60) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL6907821 0.81 TSHR (0.60) TSHRCYP3A4KAT2BACHEGPR35
SCHEMBL31672310 0.81 TSHR (0.60) TSHRCYP3A4KAT2BACHEGPR35
SCHEMBL68365 0.81 TSHR (0.60) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL16976285 0.81 TSHR (0.60) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL68019 0.81 TSHR (0.60) TSHRCYP3A4KAT2BACHEGPR35
SCHEMBL406455 0.79 TSHR (0.56) TSHRCYP3A4KAT2BMEN1RAB9A
SCHEMBL4966586 0.79 TSHR (0.56) TSHRCYP3A4KAT2BACHEGPR35

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-117138836-A Oxide/iodine composite particles and dispersion of oxide/iodine composite particles 中国石油化工股份有限公司 2023-12-01 CN claimed
CN-117138836-A Oxide/iodine composite particles and dispersion of oxide/iodine composite particles 中国石油化工股份有限公司 2023-12-01 CN disclosed