SCHEMBL11021590

SCHEMBL11021590

C=CC(=O)NCCCCOc1cccc2ccccc12.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 2/20 0.57
▸ KDM4E B2RXH2 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ HPGD P15428 3/20 0.56
▸ HRH1 P35367 1/20 0.51
▸ TGM2 P21980 3/20 0.50
▸ ATM Q13315 1/20 0.50
▸ KCNA3 P22001 1/20 0.50
▸ ITK Q08881 1/20 0.49
▸ HTR1B P28222 6/20 0.49
▸ HTR1D P28221 2/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ NR2E1 Q9Y466 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.47
▸ OGG1 O15527 1/20 0.46

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
SCHEMBL10363163 0.99 SLC6A4 (0.58) SLC6A4KDM4EALDH1A1HPGDHRH1
SCHEMBL10804531 0.88 TGM2 (0.52) SLC6A4KDM4EALDH1A1HPGDTGM2
SCHEMBL10803446 0.86 TGM2 (0.56) KDM4EALDH1A1TGM2ITKKMT2A
SCHEMBL10816283 0.86 TGM2 (0.47) SLC6A4KDM4EALDH1A1HPGDTGM2
SCHEMBL10364143 0.84 NCEH1 (0.53) ALDH1A1HPGDTGM2KMT2A
SCHEMBL10362461 0.83 L3MBTL1 (0.58) SLC6A4KDM4EALDH1A1HPGDTGM2
SCHEMBL10806417 0.82 TGM2 (0.49) KDM4EALDH1A1HPGDTGM2ITK
SCHEMBL10818993 0.82 GAA (0.54) KDM4EALDH1A1TGM2ITKKMT2A
SCHEMBL10807055 0.82 TGM2 (0.49) KDM4EALDH1A1TGM2ITKKMT2A
SCHEMBL5212699 0.82 SLC6A4 (0.64) SLC6A4KDM4EALDH1A1HPGDHRH1

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-0155177-A2 Unsaturated cyclic amido-substituted ether compounds and preparation process thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-09-18 — — EP disclosed
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