SCHEMBL14667451

SCHEMBL14667451

N#C/C(=C\c1ccccc1)CON

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.50
▸ KDM4E B2RXH2 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MAPT P10636 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ POLB P06746 3/20 0.39
▸ PKM P14618 2/20 0.39
▸ IDO1 P14902 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ PLIN1 O60240 1/20 0.39
▸ PLIN5 Q00G26 1/20 0.39
▸ ABHD5 Q8WTS1 1/20 0.39
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL1493955 0.82 MCL1 (0.46) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL11761402 0.79 MCL1 (0.55) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL11761398 0.79 MCL1 (0.55) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL4630811 0.77 MCL1 (0.52) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL4630806 0.77 MCL1 (0.52) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL10187523 0.76 MCL1 (0.50) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL9075825 0.76 MCL1 (0.50) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL18192045 0.76 MCL1 (0.50) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL14604980 0.76 MCL1 (0.50) MCL1KDM4EALDH1A1HPGDMAPT
SCHEMBL11764470 0.73 MCL1 (0.51) MCL1KDM4EALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722678-B2 Fungicidal oximes and hydrazones E I DU PONT DE NEMOURS AND COMPANY (US) 2014-05-13 — — US disclosed
US-20130030002-A1 FUNGICIDAL OXIMES AND HYDRAZONES E I DUPONT DE NEMOURS AND COMPANY (US) 2013-01-31 — — 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-20130030002-A1 FUNGICIDAL OXIMES AND HYDRAZONES NOX1, QSOX1, XDH MCL1 1617/4885KDM4E 1646/4885ALDH1A1 418/4885

“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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