SCHEMBL23631647

SCHEMBL23631647

O=C(O)CNC(=O)Cn1ccc2cc(-c3cnc4ccccc4c3)ccc21

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 8/20 0.68
▸ GRIN2B Q13224 9/20 0.50
▸ FTO Q9C0B1 1/20 0.46
▸ EGLN1 Q9GZT9 1/20 0.46
▸ EGLN3 Q9H6Z9 1/20 0.46
▸ MGLL Q99685 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL23631629 0.93 NTSR1 (0.68) NTSR1GRIN2BFTOEGLN1EGLN3
SCHEMBL23631656 0.79 NTSR1 (0.46) NTSR1KMT2A
SCHEMBL23631632 0.79 NTSR1 (0.67) NTSR1KMT2A
SCHEMBL6138108 0.78 KMT2A (0.69) NTSR1KMT2A
SCHEMBL23631570 0.76 KDM4E (0.52) NTSR1GRIN2BKMT2A
SCHEMBL23631615 0.76 NTSR1 (0.47) NTSR1GRIN2BMGLL
SCHEMBL31602786 0.76 KMT2A (0.65) NTSR1KMT2A
SCHEMBL23631580 0.75 NTSR1 (0.51) NTSR1
SCHEMBL23631648 0.74 NTSR1 (0.60) NTSR1KMT2A
SCHEMBL3599423 0.73 NTSR1 (0.56) NTSR1GRIN2B

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-20210214359-A1 Compounds and Methods for Treating Bacterial Infections UNIV NEW YORK (US) 2021-07-15 — — US claimed
US-20210214359-A1 Compounds and Methods for Treating Bacterial Infections UNIV NEW YORK (US) 2021-07-15 — — 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-20210214359-A1 Compounds and Methods for Treating Bacterial Infections CBS, MPO, QSOX1 NTSR1 2656/4885GRIN2B 3925/4885FTO 2052/4885

“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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