SCHEMBL4824285

SCHEMBL4824285

CCCCC(=O)N1CCOc2cc(Br)ccc21

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ GPR183 P32249 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL31472162 0.85 TP53 (0.44) ALDH1A1MAPTHTTTP53L3MBTL1
SCHEMBL5270784 0.80 NOTUM (0.63) MAPTTP53LMNANOTUMMEN1
SCHEMBL29209099 0.76 LMNA (0.46) MAPTHTTLMNAPOLBRAB9A
SCHEMBL30336438 0.76 LMNA (0.46) MAPTHTTLMNAPOLBRAB9A
SCHEMBL30336534 0.73 LMNA (0.51) MAPTTP53LMNANOTUM
SCHEMBL5276056 0.73 USP30 (0.50) LMNANOTUM
SCHEMBL29209024 0.73 LMNA (0.51) MAPTTP53LMNANOTUM
SCHEMBL13060109 0.73 NOTUM (0.66) ALDH1A1MAPTTP53L3MBTL1LMNA
SCHEMBL23818422 0.72 FEM1B (0.60) NAAAALDH1A1MAPTHTTTP53
SCHEMBL3957941 0.72 NAAA (0.87) NAAA

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-7365064-B2 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2008-04-29 — — US disclosed
US-20050113368-A1 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2005-05-26 — — US disclosed
EP-1436268-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2004-07-14 — — EP disclosed
WO-2003033481-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-04-24 — — 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-20050113368-A1 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them CYP3A5, HBZ, CYP4Z1 NAAA 3591/4885ALDH1A1 1644/4885MAPT 566/4885

“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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