SCHEMBL11051436

SCHEMBL11051436

CCCP(=O)(OCOC(=O)C(C)(C)C)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ TTR P02766 1/20 0.53
▸ PPOX P50336 1/20 0.53
▸ FFAR1 O14842 3/20 0.39
▸ PPARD Q03181 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ LMNA P02545 6/20 0.38
▸ MAPT P10636 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ MRGPRX4 Q96LA9 1/20 0.38
▸ CCR6 P51684 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ GPR55 Q9Y2T6 1/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL11051934 0.94 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11054533 0.89 MEN1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10851309 0.87 MEN1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11054180 0.86 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11051499 0.85 TDP1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11048200 0.85 MEN1 (0.51) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10856340 0.85 MEN1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11049687 0.83 TDP1 (0.50) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11051747 0.82 MEN1 (0.53) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11049706 0.82 TDP1 (0.55) TDP1MEN1KMT2ATTRPPOX

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-4456465-A HERBICIDES ZOECON CORPORATION (US) 1984-06-26 — — US disclosed
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