SCHEMBL22977709

SCHEMBL22977709

CO/N=C(\c1c(O)c(Cl)nn(C)c1=O)c1cccc2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 4/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ NPBWR1 P48145 1/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL22977714 1.00 HPGD (0.35) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL22977721 0.82 CNR2 (0.44) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL22977712 0.76 RAB9A (0.33) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL22977708 0.76 RAB9A (0.33) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL22977710 0.75 CNR2 (0.42) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL21178996 0.74 SMN1; SMN2 (0.33) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL22977706 0.74 SMN1; SMN2 (0.33) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL22977722 0.71 MEN1 (0.39) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL21179259 0.71 MEN1 (0.39) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL22977718 0.69 CNR2 (0.48) HPGDMEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210045385-A1 PYRIDAZINONE-SUBSTITUTED KETOXIMES AS HERBICIDES FMC CORP (US) 2021-02-18 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210045385-A1 PYRIDAZINONE-SUBSTITUTED KETOXIMES AS HERBICIDES CYP1A2, CYP1B1, CYP1A1 HPGD 538/4885MEN1 4471/4885KMT2A 655/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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