SCHEMBL8292639

SCHEMBL8292639

CC(=O)N1CCC(CNc2nccc(/C(C#N)=C3/Nc4ccccc4O3)n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 13/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ USP30 Q70CQ3 2/20 0.37
▸ BTK Q06187 1/20 0.36
▸ VCP P55072 1/20 0.35
▸ CCNT1 O60563 1/20 0.35
▸ CDK9 P50750 1/20 0.35

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
SCHEMBL5477983 1.00 GRIN2B (0.40) GRIN2BCYP11B2USP30BTKVCP
SCHEMBL5478744 1.00 GRIN2B (0.40) GRIN2BCYP11B2USP30BTKVCP
SCHEMBL6021793 0.93 GRIN2B (0.41) GRIN2BUSP30VCP
SCHEMBL6021795 0.93 GRIN2B (0.41) GRIN2BUSP30VCP
SCHEMBL5480629 0.91 GRIN2B (0.40) GRIN2BUSP30VCP
SCHEMBL5476896 0.91 GRIN2B (0.40) GRIN2BUSP30VCP
SCHEMBL14431024 0.89 GRIN2B (0.42) GRIN2B
SCHEMBL5478767 0.89 GRIN2B (0.42) GRIN2B
SCHEMBL5478765 0.89 GRIN2B (0.42) GRIN2B
SCHEMBL5473023 0.87 MAP3K14 (0.38) GRIN2BUSP30VCPCCNT1CDK9

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-20070185104-A1 Benzoxazole acetonitriles APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2007-08-09 — — US disclosed
US-20070185104-A1 Benzoxazole acetonitriles APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2007-08-09 — — US disclosed
WO-2005026159-A1 BENZOXAZOLE ACETONITRILES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-03-24 — — 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-20070185104-A1 Benzoxazole acetonitriles PKD1, PC, GPR119 GRIN2B 2653/4885CYP11B2 27/4885USP30 3096/4885

“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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