SCHEMBL7240445

SCHEMBL7240445

Nc1ccc(NC2=C(Cl)C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.74
▸ RAB9A P51151 10/20 0.74
▸ HTT P42858 10/20 0.74
▸ NPSR1 Q6W5P4 8/20 0.74
▸ KMT2A Q03164 8/20 0.74
▸ MAPK1 P28482 7/20 0.74
▸ NPC1 O15118 6/20 0.74
▸ MEN1 O00255 6/20 0.74
▸ ATM Q13315 5/20 0.74
▸ GAA P10253 4/20 0.74
▸ LMNA P02545 4/20 0.74
▸ MITF O75030 3/20 0.74
▸ SMN1; SMN2 Q16637 2/20 0.74
▸ XBP1 P17861 1/20 0.74
▸ ALDH1A1 P00352 7/20 0.65
▸ L3MBTL1 Q9Y468 4/20 0.65
▸ HPGD P15428 4/20 0.65
▸ TDP1 Q9NUW8 4/20 0.65
▸ CDC25A P30304 4/20 0.65
▸ CDC25B P30305 3/20 0.65

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
SCHEMBL31682570 0.91 RAB9A (0.62) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL32664539 0.86 MAPT (0.79) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL29633261 0.85 MAPT (1.00) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL6506683 0.85 MAPT (1.00) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL4868219 0.83 MAPT (1.00) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL4873496 0.83 MAPT (1.00) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL8663288 0.83 MAPT (0.74) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL5808588 0.82 MAPT (0.68) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL2240870 0.82 MAPT (0.68) MAPTRAB9AHTTNPSR1KMT2A
SCHEMBL12283294 0.80 MAPT (0.71) MAPTRAB9AHTTNPSR1KMT2A

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-20030232801-A1 Identification of compounds for the treatment or prevention of proliferative diseases STURGESS MICHAEL ALAN (US) 2003-12-18 — — US disclosed
US-6630589-B1 Screening assays for compounds that are potentially useful for treating or preventing a proliferative disease. The assays are based on contacting a candidate compound with a cell containing a nucleic acid including a HER2 regulatory element MESSAGE PHARMACEUTICALS 2003-10-07 — — US disclosed
WO-2002077609-A2 IDENTIFICATION OF COMPOUNDS FOR THE TREATMENT OR PREVENTION OF PROLIFERATIVE DISEASES MESSAGE PHARMACEUTICALS, INC. (US) 2002-10-03 — — 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-20030232801-A1 Identification of compounds for the treatment or prevention of proliferative diseases PCNA, TP53, MKI67 MAPT 3220/4885RAB9A 4714/4885HTT 703/4885

“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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