SCHEMBL2496752

SCHEMBL2496752

CN(C)C(=O)[C@@H]1C[C@@H](O)CN1C1(c2cccc3c2OCO3)C(=O)Nc2ccc(Br)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.39
USP2 O75604 1/20 0.39
F2 P00734 1/20 0.39
BRD4 O60885 5/20 0.39
AVPR1A P37288 4/20 0.35
AVPR1B P47901 4/20 0.35
OXTR P30559 3/20 0.35
AVPR2 P30518 2/20 0.35
GPR65 Q8IYL9 1/20 0.35
LMNA P02545 3/20 0.33
PKM P14618 1/20 0.33
GAA P10253 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSP90AA1 P07900 2/20 0.32
ALPL P05186 1/20 0.32
ALPI P09923 1/20 0.32
MAPT P10636 1/20 0.32
ALPG P10696 1/20 0.32
TLR9 Q9NR96 1/20 0.32

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
SCHEMBL2495336 0.91 BRD4 (0.41) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2498353 0.90 BRD4 (0.39) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2494027 0.90 AVPR1A (0.44) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2493428 0.88 BRD4 (0.38) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2498096 0.87 BRD4 (0.37) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2496940 0.86 BRD4 (0.38) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2495051 0.85 AVPR1A (0.42) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2497539 0.84 AVPR1A (0.38) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2497606 0.81 AVPR1A (0.36) BRD4AVPR1AAVPR1BOXTRAVPR2
SCHEMBL2494894 0.78 AVPR1A (0.41) L3MBTL1BRD4AVPR1AAVPR1BOXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 L3MBTL1 2814/4885USP2 3477/4885F2 204/4885

“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.