SCHEMBL11069022

SCHEMBL11069022

O=[N+]([O-])c1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1C1=NCCO1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
MEN1 O00255 1/20 0.57
TTR P02766 1/20 0.57
PPOX P50336 1/20 0.57
KMT2A Q03164 1/20 0.57
HPGD P15428 2/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPK1 P28482 1/20 0.41
FFAR1 O14842 5/20 0.39
FGFR4 P22455 1/20 0.36
POLB P06746 1/20 0.36
CCR6 P51684 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
MASP2 O00187 1/20 0.36

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
SCHEMBL11066015 0.94 TDP1 (0.56) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11255622 0.82 TDP1 (0.55) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11159008 0.82 TDP1 (0.55) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11240468 0.82 TDP1 (0.55) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11472139 0.80 TDP1 (0.52) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11157480 0.80 TDP1 (0.55) TDP1MEN1TTRPPOXKMT2A
SCHEMBL11159984 0.79 TDP1 (0.52) TDP1MEN1TTRPPOXKMT2A
SCHEMBL10586970 0.79 TDP1 (0.57) TDP1MEN1TTRPPOXKMT2A
SCHEMBL8694365 0.79 TDP1 (0.74) TDP1MEN1TTRPPOXKMT2A
SCHEMBL10706908 0.79 TDP1 (0.74) TDP1MEN1TTRPPOXKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0035475-B1 HERBICIDALLY ACTIVE 2-NITRO-5-PHENOXYPHENYL OXAZOLES, OXAZINES, IMIDAZOLES, PYRIMIDINES AND THIAZOLES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1983-11-30 EP claimed
US-4350519-A SELECTIVE ACTION, PRE- AND POSTEMERGENCE CIBA-GEIGY CORPORATION (US) 1982-09-21 US claimed
EP-0035475-A1 Herbicidally active 2-nitro-5-phenoxyphenyl oxazoles, oxazines, imidazoles, pyrimidines and thiazoles, their preparation and their use CIBA-GEIGY AG (CH) 1981-09-09 EP claimed
US-4431439-A PLANT GROWTH INHIBITORS; SELELCTIVE FOR CEREAL CROPS CIBA-GEIGY CORPORATION (US) 1984-02-14 US disclosed
EP-0035475-B1 HERBICIDALLY ACTIVE 2-NITRO-5-PHENOXYPHENYL OXAZOLES, OXAZINES, IMIDAZOLES, PYRIMIDINES AND THIAZOLES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1983-11-30 EP disclosed
US-4350519-A SELECTIVE ACTION, PRE- AND POSTEMERGENCE CIBA-GEIGY CORPORATION (US) 1982-09-21 US disclosed