Benzophenone

Benzophenone

SCHEMBL11258345

C.CC(=O)OCCCCOC(=O)c1cc(Br)c(N)c(CN2CCCC2)c1.O=C(c1ccccc1)c1ccccc1

nearest known ligand 0.41

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 2/20 0.41
▸ HRH4 Q9H3N8 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ SCN1A P35498 1/20 0.38
▸ SCN2A Q99250 1/20 0.38
▸ SCN3A Q9NY46 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ESR1 P03372 3/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MEN1 O00255 1/20 0.35

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
Benzophenone SCHEMBL11263532 0.99 HRH3 (0.41) SLC29A1HRH4HRH3KDM4EALDH1A1
Benzophenone SCHEMBL11271308 0.96 LTA4H (0.39) SLC29A1HRH4HRH3KDM4EALDH1A1
Benzophenone SCHEMBL11261404 0.95 KMT2A (0.39) SLC29A1HRH4HRH3KDM4EALDH1A1
Benzophenone SCHEMBL11266752 0.92 L3MBTL1 (0.41) KDM4EALDH1A1TDP1KMT2ANPSR1
Benzophenone SCHEMBL11274102 0.89 HRH3 (0.41) SLC29A1HRH3KDM4EALDH1A1LMNA
Benzophenone SCHEMBL11262001 0.88 L3MBTL1 (0.42) ALDH1A1NPSR1L3MBTL1LMNA
SCHEMBL11258342 0.85 PTGS2 (0.45) SLC29A1HRH3KDM4EALDH1A1LMNA
SCHEMBL11155210 0.85 PTGS2 (0.44) SLC29A1HRH3KDM4EALDH1A1LMNA
SCHEMBL11263518 0.85 PTGS2 (0.44) SLC29A1HRH3KDM4EALDH1A1LMNA
SCHEMBL11266856 0.84 SLC29A1 (0.40) SLC29A1ALDH1A1KMT2ANPSR1CYP2D6

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
US-4362738-A ANTIINFLAMMATORIES DR. KARL THOMAE GMBH (DE) 1982-12-07 — — US disclosed
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