SCHEMBL10852695

SCHEMBL10852695

COP(C)(=S)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ TDP1 Q9NUW8 2/20 0.60
▸ TTR P02766 1/20 0.60
▸ PPOX P50336 1/20 0.60
▸ FFAR1 O14842 5/20 0.41
▸ LMNA P02545 5/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ FGFR4 P22455 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ CCR6 P51684 1/20 0.38

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
SCHEMBL10856547 0.89 TDP1 (0.61) MEN1KMT2ATDP1TTRPPOX
SCHEMBL11132076 0.88 TDP1 (0.62) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10854243 0.87 MEN1 (0.57) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10854037 0.86 TDP1 (0.64) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10855862 0.85 TDP1 (0.66) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10948222 0.85 MEN1 (0.62) MEN1KMT2ATDP1TTRPPOX
Hydrochloric Acid SCHEMBL10854043 0.84 TDP1 (0.64) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10857434 0.84 MEN1 (0.58) MEN1KMT2ATDP1TTRPPOX
SCHEMBL11137095 0.83 TDP1 (0.68) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10855806 0.82 MEN1 (0.61) MEN1KMT2ATDP1TTRPPOX

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-4563310-A HERBICIDES ZOECON CORPORATION (US) 1986-01-07 — — US disclosed
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