SCHEMBL5597032

SCHEMBL5597032

Cc1ncc2c3c(cccc13)N(C1CCC(NCc3ccccc3)CC1)CC2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 4/20 0.41
ACHE P22303 6/20 0.40
BACE1 P56817 6/20 0.40
BCHE P06276 4/20 0.39
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
RIPK2 O43353 1/20 0.38
AKT1 P31749 1/20 0.37
FABP6 P51161 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
RAB9A P51151 1/20 0.36
EBP Q15125 1/20 0.36
DHCR7 Q9UBM7 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 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
SCHEMBL5596731 0.91 GRIN2B (0.41) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5412407 0.90 GRIN2B (0.40) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5412409 0.90 GRIN2B (0.40) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5596288 0.89 MEN1 (0.41) GRIN2BACHEBACE1BCHECARM1
SCHEMBL14594174 0.82 GRIN2B (0.42) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5419721 0.82 GRIN2B (0.42) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5419726 0.82 GRIN2B (0.42) GRIN2BACHEBACE1BCHECARM1
SCHEMBL5596945 0.81 MEN1 (0.44) RIPK2MEN1KMT2A
SCHEMBL5596442 0.80 MEN1 (0.42) RIPK2MEN1KMT2A
SCHEMBL5597208 0.80 OPRM1 (0.37) RIPK2

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
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A GRIN2B 2364/4885ACHE 1009/4885BACE1 4747/4885

“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.