SCHEMBL25962618

SCHEMBL25962618

CNCCCCc1ccc(I)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.64
▸ SIGMAR1 Q99720 7/20 0.62
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ TAAR1 Q96RJ0 4/20 0.45
▸ TMEM97 Q5BJF2 1/20 0.45
▸ ATM Q13315 1/20 0.43
▸ S1PR2 O95136 2/20 0.42
▸ S1PR1 P21453 2/20 0.42
▸ S1PR3 Q99500 2/20 0.42
▸ S1PR4 O95977 1/20 0.39
▸ ALB P02768 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
SCHEMBL2904009 0.85 TAAR1 (0.61) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL18551670 0.83 L3MBTL1 (0.64) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL14178223 0.82 MEN1 (0.74) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL18551667 0.81 L3MBTL1 (0.67) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL30229979 0.81 L3MBTL1 (0.67) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL28284957 0.79 SPHK2 (0.46) SIGMAR1
SCHEMBL6849740 0.79 TAAR1 (0.73) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL9846049 0.79 SIGMAR1 (0.68) L3MBTL1SIGMAR1MEN1KMT2AS1PR2
SCHEMBL6850797 0.79 TAAR1 (0.73) L3MBTL1SIGMAR1MEN1KMT2ATAAR1
SCHEMBL15511629 0.79 L3MBTL1 (0.64) L3MBTL1SIGMAR1MEN1KMT2ATAAR1

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
WO-2023150618-A2 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. (US) 2023-08-10 — — WO disclosed
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