SCHEMBL29973366

SCHEMBL29973366

C=C(Cc1nc(C2(c3ccc(Cl)c(F)c3)CC2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ RORC P51449 1/20 0.32
▸ SLC6A3 Q01959 4/20 0.31
▸ SLC6A4 P31645 3/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPT P10636 1/20 0.31

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
SCHEMBL23578075 1.00 MEN1 (0.33) MEN1HTTKMT2ARORCSLC6A3
SCHEMBL23578490 0.87 KMT2A (0.37) MEN1HTTKMT2ARORCSLC6A3
SCHEMBL23588153 0.87 MEN1 (0.37) MEN1HTTKMT2ALMNAMAPT
SCHEMBL23578140 0.86 SLC6A3 (0.34) MEN1HTTKMT2ARORCSLC6A3
SCHEMBL29844081 0.86 SLC6A3 (0.34) MEN1HTTKMT2ARORCSLC6A3
SCHEMBL23578539 0.85 CCR5 (0.36) MEN1HTTKMT2AMAPT
SCHEMBL25801965 0.85 MEN1 (0.32) MEN1HTTKMT2A
SCHEMBL25801800 0.84 KMT2A (0.46) MEN1HTTKMT2ASLC6A3LMNA
SCHEMBL23588062 0.83 KMT2A (0.40) MEN1HTTKMT2ALMNAMAPT
SCHEMBL23588264 0.83 MEN1 (0.36) MEN1HTTKMT2ALMNAMAPT

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
EP-4081511-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES Sitryx Therapeutics Limited (GB) 2022-11-02 — — EP disclosed
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