SCHEMBL10452398

SCHEMBL10452398

COC(=O)CN(O)C(=O)c1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.56
▸ KMT2A Q03164 4/20 0.47
▸ ATM Q13315 1/20 0.47
▸ SMN1; SMN2 Q16637 6/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TTR P02766 1/20 0.47
▸ PPOX P50336 1/20 0.47
▸ ALDH1A1 P00352 6/20 0.45
▸ HPGD P15428 2/20 0.45
▸ HTT P42858 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ LIPE Q05469 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ XBP1 P17861 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ FFAR1 O14842 1/20 0.43
▸ FAAH O00519 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL10696879 0.85 TDP1 (0.67) LMNAKMT2ASMN1; SMN2MEN1TDP1
SCHEMBL10452399 0.85 LMNA (0.56) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL11455024 0.85 KMT2A (0.61) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL10515253 0.82 LMNA (0.55) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL10451997 0.82 LMNA (0.54) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL10452504 0.82 KMT2A (0.69) LMNAKMT2AATMSMN1; SMN2MEN1
Potassium Ion SCHEMBL11458215 0.81 KMT2A (0.56) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL11455998 0.81 KMT2A (0.56) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL10775218 0.81 SMN1; SMN2 (0.58) LMNAKMT2AATMSMN1; SMN2MEN1
SCHEMBL10775901 0.80 LMNA (0.49) LMNAKMT2AATMSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0378193-A2 Herbicidal composition and the use thereof MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-07-18 — — EP disclosed
EP-0334041-A2 Herbicidal composition MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-09-27 — — EP disclosed
EP-0299382-A1 2-nitro-5-(substituted pyridyloxy)benzohydroximic acid derivatives MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-01-18 — — EP disclosed
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