SCHEMBL10399116

SCHEMBL10399116

CCCCCCCCc1cc(Cn2c(=O)n(Cc3ccc(O)c(CCCCCCCC)c3)c(=O)n(Cc3ccc(O)c(CCCCCCCC)c3)c2=O)ccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT8 Q9H7Z6 3/20 0.48
▸ TYR P14679 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ PPARA Q07869 1/20 0.44
▸ ESR1 P03372 2/20 0.44
▸ ADRA2A P08913 2/20 0.44
▸ ADORA3 P0DMS8 2/20 0.44
▸ TACR2 P21452 2/20 0.44
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ SLC6A3 Q01959 2/20 0.44

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
SCHEMBL7603592 1.00 KAT8 (0.48) KAT8TYRTP53CYP3A4MEN1
SCHEMBL7602848 1.00 KAT8 (0.48) KAT8TYRTP53CYP3A4MEN1
SCHEMBL20615288 0.94 BACE1 (0.45) KAT8TYRALOX5HTTESR1
SCHEMBL21289229 0.89 BACE1 (0.41) KAT8TYRALOX5KDM4EALDH1A1
SCHEMBL21569772 0.84 TYR (0.42) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL1024794 0.82 KAT8 (0.61) KAT8TYRTP53CYP3A4MEN1
SCHEMBL8392959 0.82 KAT8 (0.61) KAT8TYRTP53CYP3A4MEN1
SCHEMBL11781504 0.82 KAT8 (0.61) KAT8TYRTP53CYP3A4MEN1
SCHEMBL8390293 0.82 KAT8 (0.61) KAT8TYRTP53CYP3A4MEN1
SCHEMBL1023097 0.82 KAT8 (0.61) KAT8TYRTP53CYP3A4MEN1

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-4923909-A THIXOTROPIC SLURRYING; PIPES; STABILITY; THERMOPLASTIC OR THERMOSETTING RESIN; LIQUID CARRIER THE B. F. GOODRICH COMPANY (US) 1990-05-08 — — US disclosed
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