SCHEMBL10947425

SCHEMBL10947425

Cc1c(F)c(F)c(Oc2ccc([N+](=O)[O-])c(O)c2)c(Cl)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 1/20 0.39
▸ KIF11 P52732 4/20 0.36
▸ TDP1 Q9NUW8 3/20 0.36
▸ ALDH1A1 P00352 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MITF O75030 1/20 0.36
▸ CCR6 P51684 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ TTR P02766 2/20 0.35
▸ PPOX P50336 1/20 0.35
▸ ALB P02768 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ PDE7A Q13946 1/20 0.34
▸ SIRT6 Q8N6T7 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
SCHEMBL11287905 0.89 ALDH1A1 (0.46) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL10766268 0.88 TDP1 (0.42) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL11411623 0.86 MEN1 (0.38) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL9120594 0.85 MEN1 (0.52) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL11190333 0.85 TDP1 (0.43) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL10430085 0.84 TDP1 (0.43) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL10890833 0.83 MAPT (0.37) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL11213666 0.83 TDP1 (0.57) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL10608335 0.83 KMT2A (0.36) TDP1ALDH1A1MAPTLMNAHTT
SCHEMBL31118409 0.83 GPR35 (0.49) GPR35KIF11TDP1ALDH1A1MAPT

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
Send feedback