SCHEMBL16385607

SCHEMBL16385607

Cc1ccccc1OCc1c(Br)cccc1C(=O)Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.49
▸ RXRB P28702 1/20 0.49
▸ RXRG P48443 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.46
▸ SLC22A12 Q96S37 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ SGMS2 Q8NHU3 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PTGER1 P34995 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL16384996 0.88 ALDH1A1 (0.45) RXRARXRBRXRGALDH1A1SLC22A12
SCHEMBL17788267 0.85 MRGPRX4 (0.53) SLC22A12FFAR4SMN1; SMN2MEN1NPC1
SCHEMBL17788271 0.85 SLC22A12 (0.44) ALDH1A1SLC22A12TDP1L3MBTL1FFAR4
SCHEMBL16385008 0.82 ALDH1A1 (0.51) RXRARXRBRXRGALDH1A1TDP1
SCHEMBL17788278 0.82 SLC22A12 (0.41) ALDH1A1SLC22A12FFAR4NPSR1SMN1; SMN2
SCHEMBL16385462 0.81 ALDH1A1 (0.40) RXRARXRBRXRGALDH1A1SLC22A12
SCHEMBL16385318 0.81 RXRA (0.44) RXRARXRBRXRGALDH1A1SLC22A12
SCHEMBL17788277 0.81 MRGPRX4 (0.47) ALDH1A1SLC22A12FFAR4NPSR1PTGER1
SCHEMBL16385322 0.77 SLC22A12 (0.54) RXRARXRBRXRGSLC22A12L3MBTL1
SCHEMBL17788264 0.77 MRGPRX4 (0.55) SLC22A12FFAR4SMN1; SMN2MEN1NPC1

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-2015005499-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 (JP) 2015-01-15 — — WO disclosed
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