SCHEMBL6841547

SCHEMBL6841547

CN1C(=O)CC(c2cccc(Cl)c2)c2cc(CN(c3ccc(Cl)cc3)c3cncn3C)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.46
FNTB P49356 3/20 0.46
PGGT1B P53609 1/20 0.38
ACHE P22303 1/20 0.35
MDM2 Q00987 5/20 0.34
GABRA1 P14867 3/20 0.34
GABRG2 P18507 3/20 0.34
GABRB3 P28472 3/20 0.34
GABRA5 P31644 3/20 0.34
GABRA3 P34903 3/20 0.34
GABRA2 P47869 3/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 0.34
GABRE P78334 2/20 0.34
GABRA6 Q16445 2/20 0.34
GABRG1 Q8N1C3 2/20 0.34
GABRG3 Q99928 2/20 0.34

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
SCHEMBL6841546 0.75 FNTA (0.76) FNTAFNTBPGGT1B
SCHEMBL5513838 0.75 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL6841549 0.74 FNTA (0.46) FNTAFNTBPGGT1BMDM2GABRA1
SCHEMBL1538326 0.70 MDM2 (0.40) FNTAFNTBMDM2GAALMNA
SCHEMBL4371974 0.63 FNTA (0.81) FNTAFNTBPGGT1B
SCHEMBL4372438 0.62 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL4381345 0.62 FNTA (0.83) FNTAFNTBPGGT1BMDM2
SCHEMBL4373317 0.62 FNTA (0.59) FNTAFNTBPGGT1B
SCHEMBL4373656 0.61 FNTA (0.82) FNTAFNTBPGGT1B
SCHEMBL5562152 0.61 FNTA (0.52) FNTAFNTBPGGT1BMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063770-A1 Method for treating Alzheimer's disease WARNER-LAMBERT COMPANY 2004-04-01 US claimed
US-20010051642-A1 Method for treating Alzheimer's disease AHN KYUNGHYE (US) 2001-12-13 US claimed
US-20040063770-A1 Method for treating Alzheimer's disease WARNER-LAMBERT COMPANY 2004-04-01 US disclosed
US-20010051642-A1 Method for treating Alzheimer's disease AHN KYUNGHYE (US) 2001-12-13 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 (2 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-20040063770-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 FNTA 15/4885FNTB 31/4885PGGT1B 232/4885
US-20010051642-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 FNTA 15/4885FNTB 31/4885PGGT1B 232/4885

“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.