SCHEMBL29338763

SCHEMBL29338763

CC(C)c1cnc(F)c(N)n1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
P2RX3 P56373 1/20 0.31
P2RX2 Q9UBL9 1/20 0.31
HTR1B P28222 1/20 0.31
HTR2B P41595 1/20 0.31
GPR65 Q8IYL9 1/20 0.31

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
SCHEMBL29335016 0.83 NOS3 (0.35) NOS3NOS1NOS2P2RX3P2RX2
SCHEMBL29335014 0.80 NOS3 (0.39) NOS3NOS1NOS2P2RX3P2RX2
SCHEMBL29333356 0.77 NOS3 (0.32) NOS3NOS1NOS2
SCHEMBL25910823 0.76 NOS3 (0.33) NOS3NOS1NOS2
SCHEMBL25910824 0.75 NOS3 (0.35) NOS3NOS1NOS2P2RX3P2RX2
SCHEMBL25951870 0.75
SCHEMBL25910820 0.75 CYP3A4 (0.35) NOS3NOS1NOS2
SCHEMBL18722041 0.72 NOS3 (0.41) NOS3NOS1NOS2P2RX3P2RX2
SCHEMBL21161269 0.72
SCHEMBL30068288 0.72 P2RX3 (0.36) NOS3NOS1NOS2P2RX3P2RX2

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-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 US disclosed
WO-2024073587-A1 N-ACRYLOYLMORPHOLINE DERIVATIVES AS KEAP1 MODULATORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. (US) 2024-04-04 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-20240226114-A1 INHIBITORS AND USES THEREOF KEAP1, NQO1, NFE2L2 NOS3 1318/4885NOS1 1279/4885NOS2 1075/4885

“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.