SCHEMBL10847036

SCHEMBL10847036

CCOP(=O)(OCC)c1cc(Oc2ncc(Cl)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ MAPK1 P28482 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LIPE Q05469 4/20 0.41
▸ BCHE P06276 2/20 0.41
▸ PIN1 Q13526 2/20 0.40
▸ MERTK Q12866 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ DRD1 P21728 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PPARG P37231 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ PSMD14 O00487 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL10957034 0.91 LMNA (0.46) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10851965 0.88 TSHR (0.50) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10855208 0.88 MAPK1 (0.48) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10845769 0.87 LMNA (0.49) LMNASMN1; SMN2LIPEALDH1A1MAPT
SCHEMBL11052171 0.86 LMNA (0.48) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10854845 0.84 LMNA (0.46) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10847158 0.84 TSHR (0.52) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10859868 0.80 LIPE (0.42) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL10846359 0.79 TSHR (0.62) LMNASMN1; SMN2TSHRCYP2C9APEX1
SCHEMBL11000058 0.79 PIN1 (0.40) LMNASMN1; SMN2TSHRCYP2C9APEX1

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
EP-0071572-B1 DERIVATIVES OF 2-NITRO-4- OR-5-PYRIDYLOXY-PHENYLPHOSPHONIC ACID, PROCESS FOR THEIR PREPARATION, THEIR USE AS HERBICIDES AND/OR REGULATORS OF PLANT GROWTH AND/OR MICROBICIDES, AS WELL AS THE INTERMEDIATES USED FOR THEIR PREPARATION, THE PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES CIBA-GEIGY AG (CH) 1985-08-28 — — EP claimed
US-4451284-A Derivatives of 2-nitro-4- or -5-pyridyloxyphenylphosphonic acid, the preparation thereof, the use thereof as herbicides and/or plant growth regulators CIBA-GEIGY CORPORATION (US) 1984-05-29 — — US claimed
US-4610980-A PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1986-09-09 — — US disclosed
US-4451284-A Derivatives of 2-nitro-4- or -5-pyridyloxyphenylphosphonic acid, the preparation thereof, the use thereof as herbicides and/or plant growth regulators CIBA-GEIGY CORPORATION (US) 1984-05-29 — — US disclosed
Send feedback