SCHEMBL9514040

SCHEMBL9514040

COCC1OCN(c2ccc3c(OC)cccc3c2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 3/20 0.36
▸ IRAK4 Q9NWZ3 5/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 3/20 0.33
▸ HCRTR1 O43613 2/20 0.33
▸ HCRTR2 O43614 2/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NQO1 P15559 1/20 0.33

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
SCHEMBL9211673 0.83 SLC6A2 (0.44) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL9208921 0.78 HTR1A (0.42) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL9514034 0.78 GRM2 (0.50) —
SCHEMBL9206576 0.77 SLC6A2 (0.33) —
SCHEMBL9211887 0.77 MIF (0.34) ALDH1A1MEN1KMT2A
SCHEMBL9211643 0.77 MIF (0.34) ALDH1A1MEN1KMT2A
SCHEMBL9214055 0.76 MIF (0.34) MEN1KMT2AMAPT
SCHEMBL9210057 0.75 CA12 (0.39) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL9205405 0.74 LMNA (0.38) ALDH1A1TDP1
SCHEMBL9204689 0.73 ALOX5 (0.44) ALDH1A1HPGDMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5155772-A — — None — — JP disclosed
JP-H05155772-A ANTIDEPRESSANT TANABE SEIYAKU CO LTD 1993-06-22 — — JP disclosed
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