SCHEMBL10949055

SCHEMBL10949055

CC(Oc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-])P(C)(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ TTR P02766 1/20 0.60
▸ PPOX P50336 1/20 0.60
▸ FFAR1 O14842 5/20 0.44
▸ LMNA P02545 5/20 0.40
▸ MAPT P10636 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ CCR6 P51684 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ CYP2C9 P11712 1/20 0.37

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
SCHEMBL10948291 0.92 TDP1 (0.60) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10943534 0.90 MEN1 (0.57) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10944416 0.90 TDP1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10948614 0.89 TDP1 (0.57) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10874835 0.88 TDP1 (0.55) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10875493 0.88 MEN1 (0.57) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10949685 0.87 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10953255 0.84 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10950904 0.84 MEN1 (0.53) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11347907 0.84 MEN1 (0.62) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4556520-A HERBICIDES, INSECTICIDES ZOECON CORPORATION (US) 1985-12-03 — — US disclosed
US-4536355-A Phenoxyphenylaminoalkylphosphinates useful in weed control ZOECON CORPORATION (US) 1985-08-20 — — US disclosed
US-4456464-A Phenoxy- and pyridyloxy-phenoxyalkyl phosphinates and related sulfur compounds for weed control ZOECON CORPORATION (US) 1984-06-26 — — US disclosed
EP-0078536-A2 Phosphinates and phosphonates and their use in the control of weeds SANDOZ AG (CH) 1983-05-11 — — EP disclosed
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