SCHEMBL25017993

SCHEMBL25017993

CCCCC(CCC)c1ncccn1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TLR8 Q9NR97 4/20 0.33
IDO1 P14902 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
KCNA5 P22460 1/20 0.32
KCNH2 Q12809 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
SCHEMBL23709479 0.98 BDKRB2 (0.35) BDKRB2CYP1A2CYP2D6CYP19A1CYP2C9
SCHEMBL7524050 0.94 DNM1 (0.34) BDKRB2TLR8
SCHEMBL26078434 0.92 LMNA (0.36) KCNH2
SCHEMBL19134116 0.92 DNM1 (0.38) KCNH2
SCHEMBL21715637 0.91 OPRM1 (0.34) BDKRB2CYP1A2CYP2D6CYP19A1CYP2C9
SCHEMBL13632434 0.91 KCNA5 (0.35) CYP2D6TLR8TLR7KCNA5KCNH2
SCHEMBL21029966 0.89 LMNA (0.37) KCNH2
SCHEMBL18948470 0.89 LMNA (0.37) KCNH2
SCHEMBL24688358 0.89 LMNA (0.37) KCNH2
SCHEMBL21004269 0.89 LMNA (0.37) KCNH2

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-20230143804-A1 FLUOROALKYL-OXADIAZOLES AND USES THEREOF TENAYA THERAPEUTICS, INC. 2023-05-11 US disclosed
US-11578066-B1 Fluoroalkyl-oxadiazoles and uses thereof TENAYA THERAPEUTICS, INC. (US) 2023-02-14 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 (2 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-11578066-B1 Fluoroalkyl-oxadiazoles and uses thereof HDAC6, HDAC1, HDAC3 BDKRB2 4547/4885CYP1A2 2523/4885CYP2D6 3649/4885
US-20230143804-A1 FLUOROALKYL-OXADIAZOLES AND USES THEREOF HDAC6, HDAC1, HDAC3 BDKRB2 4604/4885CYP1A2 2892/4885CYP2D6 4083/4885

“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.