SCHEMBL9004487

SCHEMBL9004487

CCC=Cc1ccc(CCl)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
KCNH2 Q12809 2/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
TUBB1 Q9H4B7 1/20 0.33
TNNC1 P63316 1/20 0.33
LTA4H P09960 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL9497613 1.00 ALOX5 (0.35) ALOX5PTGS1PTGS2KCNH2CYP4F2
SCHEMBL31198263 0.83 TNNC1 (0.40) ALOX5PTGS1PTGS2KCNH2CYP4F2
SCHEMBL9131824 0.82 ALOX5 (0.50) ALOX5PTGS1PTGS2TUBB1MAOA
SCHEMBL2130784 0.82 CA1 (0.35) CYP4F2CYP4A11CA1CA2LTA4H
SCHEMBL9131838 0.82 ALOX5 (0.50) ALOX5PTGS1PTGS2TUBB1MAOA
SCHEMBL11835189 0.81 CA1 (0.41) ALOX5PTGS1PTGS2CA1CA2
SCHEMBL11835184 0.81 CA1 (0.41) ALOX5PTGS1PTGS2CA1CA2
SCHEMBL28159433 0.80 TNNC1 (0.48) ALOX5PTGS1PTGS2KCNH2TNNC1
SCHEMBL12655560 0.78 ALOX5 (0.35) ALOX5PTGS1PTGS2KCNH2CYP4F2
SCHEMBL4661738 0.78 HDAC8 (0.44) ALOX5PTGS1PTGS2CYP4F2CYP4A11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118932196-A Method for separating rhenium and molybdenum by utilizing quaternary phosphonium salt modified material 武汉轻工大学 2024-11-12 CN claimed
CN-118932196-A Method for separating rhenium and molybdenum by utilizing quaternary phosphonium salt modified material 武汉轻工大学 2024-11-12 CN disclosed
EP-0442097-B1 Poly(arylenevinylene siloxanes) CONSORTIUM ELEKTROCHEM IND (DE) 1996-10-09 EP disclosed
US-5185419-A POLY(ARYLENEVINYLENESILOXANES) COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE GMBH (DE) 1993-02-09 US disclosed
EP-0442097-A2 Poly(arylenevinylene siloxanes) Consortium für elektrochemische Industrie GmbH (DE) 1991-08-21 EP disclosed