SCHEMBL3494783

SCHEMBL3494783

COC(=O)c1ccc(OCC2CN(C(=O)OC(C)(C)C)CCN2C(=O)c2cc(C)n(-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
TP53 P04637 2/20 0.41
KAT7 O95251 1/20 0.39
ABHD6 Q9BV23 1/20 0.38
DAGLA Q9Y4D2 1/20 0.38
MAPT P10636 2/20 0.38
ROCK2 O75116 1/20 0.38
BACE1 P56817 1/20 0.38
ADAM17 P78536 2/20 0.37
USP30 Q70CQ3 2/20 0.37
CHEK2 O96017 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MITF O75030 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MMP12 P39900 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
SCHEMBL3493553 0.94 KAT7 (0.38) KAT7ABHD6DAGLAROCK2ADAM17
SCHEMBL3493772 0.94 USP30 (0.38) LMNATP53KAT7ABHD6DAGLA
SCHEMBL13340346 0.93 CHEK2 (0.41) KAT7ABHD6DAGLAROCK2ADAM17
SCHEMBL3496017 0.92 TP53 (0.44) LMNATP53MAPTALDH1A1MITF
SCHEMBL13340161 0.91 KAT7 (0.38) KAT7ABHD6DAGLAROCK2ADAM17
SCHEMBL3491920 0.90 ABHD6 (0.38) KAT7ABHD6DAGLAADAM17
SCHEMBL3493592 0.89 KAT7 (0.37) LMNATP53KAT7ABHD6DAGLA
SCHEMBL3492817 0.88 ABHD6 (0.38) KAT7ABHD6DAGLAADAM17
SCHEMBL3492179 0.88 USP30 (0.40) LMNATP53KAT7ABHD6DAGLA
SCHEMBL8239061 0.87 TP53 (0.44) LMNATP53MAPTALDH1A1MITF

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
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 US disclosed
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 US disclosed
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 LMNA 201/4885TP53 4747/4885KAT7 1058/4885

“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.