SCHEMBL5355200

SCHEMBL5355200

CON(C)C(=O)c1ccc2c(c1)nc(NC(C)C)c1n[nH]c(=O)n12

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.38
CRBN Q96SW2 2/20 0.36
BRD4 O60885 9/20 0.36
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
TP53 P04637 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
SCHEMBL5350993 0.86 TNKS (0.42) ADORA1BRD4LMNATP53
SCHEMBL5351179 0.85 ADORA1 (0.45) ADORA1BRD4LMNASMN1; SMN2HIF1A
SCHEMBL5358536 0.83 CRBN (0.44) ADORA1CRBNBRD4
SCHEMBL5355195 0.83 BRD4 (0.43) ADORA1BRD4LMNATP53
SCHEMBL5368068 0.82 ADORA1 (0.40) ADORA1CRBNLMNASMN1; SMN2HIF1A
SCHEMBL5362228 0.82 BRD4 (0.42) BRD4LMNASMN1; SMN2HIF1A
SCHEMBL5359257 0.79 ADORA1 (0.41) ADORA1CRBNBRD4SMN1; SMN2
SCHEMBL5356781 0.77 ADORA1 (0.45) ADORA1LMNASMN1; SMN2HIF1A
SCHEMBL5356212 0.75 ADORA1 (0.40) ADORA1LMNASMN1; SMN2HIF1A
SCHEMBL5350960 0.74 ACSS2 (0.44) ADORA1BRD4LMNATP53

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-7202245-B2 Substituted 4-amino[1,2,4]triazolo[4,3-a] quinoxalines PFIZER INC. (US) 2007-04-10 US disclosed
US-20040192698-A1 Substituted 4-amino[1,2,4]triazolo[4,3-a] quinoxalines PFIZER INC. 2004-09-30 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-20040192698-A1 Substituted 4-amino[1,2,4]triazolo[4,3-a] quinoxalines CYP4B1, CYP3A4, CYP1B1 ADORA1 12/4885CRBN 2904/4885BRD4 784/4885

“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.