SCHEMBL10615069

SCHEMBL10615069

CCCC(C)(C)C(=O)Nc1ccc(C(C)C)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ CYP3A4 P08684 1/20 0.41
▸ NPY2R P49146 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RORC P51449 1/20 0.40
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ AR P10275 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
SCHEMBL8100310 0.85 MEN1 (0.70) MEN1KMT2ATDP1CYP3A4NPY2R
SCHEMBL22059614 0.79 CYP1A2 (0.50) MEN1KMT2AGAALMNARORC
SCHEMBL10521379 0.77 CYP3A4 (0.69) MEN1KMT2ACYP3A4ALDH1A1LMNA
SCHEMBL8541417 0.77 MEN1 (1.00) MEN1KMT2ATDP1CYP3A4ALDH1A1
SCHEMBL54004 0.77 MEN1 (1.00) MEN1KMT2ATDP1CYP3A4ALDH1A1
SCHEMBL18814934 0.76 MEN1 (0.62) MEN1KMT2ATDP1GAAALDH1A1
SCHEMBL148873 0.76 HSD17B10 (0.57) MEN1KMT2ACYP3A4ALDH1A1LMNA
SCHEMBL19366192 0.75 RORC (0.60) MEN1KMT2AGAAALDH1A1RORC
SCHEMBL2123696 0.75 EPHX1 (0.46) MEN1KMT2ACYP3A4ALDH1A1LMNA
SCHEMBL11867606 0.75 MEN1 (0.64) MEN1KMT2ATDP1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63023804-A — — None — — JP disclosed
JP-S6323804-A BLENDED HERBICIDE MITSUI TOATSU CHEM INC 1988-02-01 — — JP disclosed
JP-S06323804-A — — 0001-01-01 — — JP disclosed
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