SCHEMBL20344725

SCHEMBL20344725

CSOCCCCOCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ TSHR P16473 1/20 0.50
▸ HRH4 Q9H3N8 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ NAAA Q02083 3/20 0.40
▸ GBA1 P04062 2/20 0.39
▸ UGCG Q16739 2/20 0.39
▸ GBA2 Q9HCG7 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL24675563 0.98 L3MBTL1 (0.54) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL2640223 0.84 TSHR (0.70) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL9011734 0.82 TSHR (0.67) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL9011595 0.82 TSHR (0.67) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL9011646 0.82 TSHR (0.67) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL9011624 0.82 TSHR (0.67) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL9011715 0.82 TSHR (0.67) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL18841197 0.81 L3MBTL1 (0.51) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL21184508 0.80 TSHR (0.64) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL25195898 0.80 TSHR (0.64) L3MBTL1TDP1TSHRHRH4HRH3

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-3342768-A1 [4-(1, 3, 3-TRIMETHYL-2-OXO-3, 4-DIHYDRO-1H-QUINOXALIN-7-YL) PHENOXY]ETHYLOXY COMPOUND OR SALT THEREOF Santen Pharmaceutical Co., Ltd. (JP) 2018-07-04 — — EP disclosed
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