SCHEMBL10847158

SCHEMBL10847158

O=[N+]([O-])c1ccc(Oc2ncc(Cl)cc2Cl)cc1P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ APEX1 P27695 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPK1 P28482 2/20 0.50
▸ LIPE Q05469 4/20 0.43
▸ PIN1 Q13526 4/20 0.42
▸ BCHE P06276 1/20 0.40
▸ MERTK Q12866 1/20 0.40
▸ PPARG P37231 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ IP6K1 Q92551 2/20 0.37
▸ IP6K3 Q96PC2 2/20 0.37
▸ IP6K2 Q9UHH9 2/20 0.37
▸ DRD1 P21728 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ HTT P42858 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
SCHEMBL10855208 0.88 MAPK1 (0.48) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10851965 0.86 TSHR (0.50) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10847282 0.86 RAB9A (0.52) LMNASMN1; SMN2LIPETDP1ALDH1A1
SCHEMBL11052171 0.84 LMNA (0.48) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10846359 0.84 TSHR (0.62) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10847036 0.84 LMNA (0.47) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10854845 0.83 LMNA (0.46) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL10957034 0.83 LMNA (0.46) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL11011256 0.81 TSHR (0.57) TSHRLMNACYP2C9APEX1SMN1; SMN2
SCHEMBL11005079 0.80 TDP1 (0.54) TSHRLMNACYP2C9APEX1SMN1; SMN2

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
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