SCHEMBL10448877

SCHEMBL10448877

CC(Cc1ccccc1-c1ccccc1)OO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.56
▸ DPP4 P27487 1/20 0.46
▸ PDCD1 Q15116 1/20 0.44
▸ CD274 Q9NZQ7 1/20 0.44
▸ KCNA5 P22460 3/20 0.44
▸ KCNH2 Q12809 3/20 0.44
▸ MME P08473 1/20 0.44
▸ ACE P12821 1/20 0.44
▸ CPA1 P15085 1/20 0.44
▸ ACE2 Q9BYF1 1/20 0.44
▸ PTGER1 P34995 1/20 0.42
▸ PTGER4 P35408 1/20 0.42
▸ PTGER3 P43115 1/20 0.42
▸ PTGER2 P43116 1/20 0.42
▸ SLC6A2 P23975 4/20 0.40
▸ SLC6A4 P31645 4/20 0.40
▸ PPARA Q07869 2/20 0.40
▸ PPARG P37231 1/20 0.40
▸ SLC6A3 Q01959 3/20 0.39
▸ CYP2D6 P10635 1/20 0.39

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
SCHEMBL6358266 0.82 GABRA1 (0.41) KCNH2SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5272384 0.79 KMT2A (0.61) KMT2ADPP4PDCD1CD274KCNA5
SCHEMBL8861750 0.79 KMT2A (0.57) KMT2ADPP4PDCD1CD274KCNA5
SCHEMBL4630258 0.79 KMT2A (0.60) KMT2ADPP4PDCD1CD274KCNA5
SCHEMBL6493977 0.78 KMT2A (0.51) KMT2ADPP4PDCD1CD274KCNA5
SCHEMBL27527250 0.78 KMT2A (0.59) KMT2ADPP4PDCD1CD274KCNA5
Bicarbonate SCHEMBL28036762 0.77 KMT2A (0.54) KMT2AKCNH2MMEACECPA1
Bicarbonate SCHEMBL27541289 0.76 KMT2A (0.68) KMT2ADPP4PDCD1CD274KCNA5
SCHEMBL9899517 0.76 LMNA (0.38) KCNH2SLC6A2SLC6A4
SCHEMBL5610692 0.76 KMT2A (0.61) KMT2ADPP4PDCD1CD274KCNA5

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-0394813-A2 Melt processable thermotropic aromatic copolyesters and process for preparing same THE DOW CHEMICAL COMPANY (US) 1990-10-31 — — EP disclosed
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