SCHEMBL28585058

SCHEMBL28585058

CCc1[c]n2cc(Br)ccc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 1/20 0.36
▸ AHR P35869 7/20 0.33
▸ GAA P10253 1/20 0.33
▸ APP P05067 3/20 0.32
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.30
▸ TP53 P04637 1/20 0.30

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
SCHEMBL16033289 0.77 AHR (0.39) PIK3CGAHRGAAAPPNPC1
SCHEMBL29036635 0.73 PIK3CG (0.47) PIK3CGAHRGAAAPPNPC1
SCHEMBL21373266 0.71 MAPK1 (0.36) GAANPC1RAB9AMEN1ALDH1A1
SCHEMBL22612479 0.71 KDM4E (0.34) RAB9ATSHRALDH1A1SMN1; SMN2
SCHEMBL28548228 0.68 AHR (0.38) PIK3CGAHRGAANPC1RAB9A
SCHEMBL21373269 0.64 — —
SCHEMBL1500151 0.64 PIK3CG (0.55) PIK3CGAPPNPC1RAB9ATSHR
SCHEMBL16051979 0.62 GAA (0.49) GAANPC1RAB9ATSHRMAPK10
SCHEMBL16082934 0.61 GAA (0.44) PIK3CGGAAAPPNPC1RAB9A
SCHEMBL17224416 0.61 PIK3CG (0.37) PIK3CGAHRGAANPC1RAB9A

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-108484600-B URAT1 inhibitors for promoting uric acid excretion 江苏新元素医药科技有限公司 2022-12-13 — — CN disclosed
CN-108084186-B URAT1 inhibitor and application thereof 江苏新元素医药科技有限公司 2021-06-25 — — CN disclosed
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