SCHEMBL6328547

SCHEMBL6328547

COc1ccc(-c2noc(CCC(=O)NCCN)n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.69
▸ LMNA P02545 4/20 0.67
▸ ATM Q13315 1/20 0.67
▸ TSHR P16473 4/20 0.67
▸ HPGD P15428 3/20 0.67
▸ POLB P06746 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.63
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ GAA P10253 1/20 0.62
▸ USP2 O75604 1/20 0.62
▸ MAPK1 P28482 1/20 0.62
▸ HDAC1 Q13547 1/20 0.62
▸ TP53 P04637 1/20 0.61

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
SCHEMBL6327470 0.84 MAPT (0.64) MAPTLMNAATMTSHRHPGD
SCHEMBL5717772 0.82 LMNA (0.79) MAPTLMNAATMHPGDPOLB
SCHEMBL1567346 0.81 LMNA (1.00) MAPTLMNAATMTSHRHPGD
SCHEMBL19380008 0.80 KDM4E (0.52) MAPTLMNAATMGAATP53
SCHEMBL20663366 0.77 SIRT2 (0.59) MAPTLMNAATMTSHRSMN1; SMN2
SCHEMBL6323563 0.77 TSHR (0.57) MAPTLMNAATMTSHRHPGD
SCHEMBL6324750 0.77 TSHR (0.57) MAPTLMNAATMTSHRHPGD
SCHEMBL6324829 0.76 GAA (0.56) MAPTLMNAATMTSHRHPGD
SCHEMBL6328474 0.76 GAA (0.57) MAPTLMNAATMTSHRHPGD
SCHEMBL6328013 0.76 TSHR (0.57) MAPTLMNAATMTSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423120-A4 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORP (US) 2005-12-28 — — EP disclosed
US-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 — — US disclosed
EP-1423120-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2004-06-02 — — EP disclosed
US-20040087588-A1 Parp inhibitors ICOS CORPORATION 2004-05-06 — — US disclosed
WO-2003015785-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2003-02-27 — — WO 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-20040087588-A1 Parp inhibitors PARP1, PARP2, PARP11 MAPT 729/4885LMNA 448/4885ATM 414/4885

“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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