SCHEMBL26686808

SCHEMBL26686808

FC(F)(F)CNc1cc(I)ccn1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 5/20 0.35
IL1B P01584 1/20 0.35
NLRP3 Q96P20 1/20 0.35
IDH1 O75874 1/20 0.34
BUB1 O43683 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
NUDT1 P36639 1/20 0.33
NOS2 P35228 1/20 0.33
GPR39 O43194 1/20 0.32
PDE10A Q9Y233 1/20 0.32
CDK4 P11802 1/20 0.32
CDK2 P24941 1/20 0.32
GRM1 Q13255 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 1/20 0.31
IDH2 P48735 1/20 0.30

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
Lithium SCHEMBL30633379 0.98 IRAK4 (0.35) IRAK4IL1BNLRP3IDH1BUB1
SCHEMBL26686533 0.83 BUB1 (0.38) BUB1NOS2
SCHEMBL17700752 0.79 NOS2 (0.54) NOS2MEN1KMT2APOLB
SCHEMBL31294545 0.79 IL1B (0.43) IRAK4IL1BNLRP3BUB1GPR39
SCHEMBL17700712 0.79 MAPK1 (0.48) NOS2IDH2
SCHEMBL24605491 0.79 MEN1 (0.41) IRAK4IL1BNLRP3IDH1BUB1
SCHEMBL17372267 0.76 LOXL2 (0.55) LOXL2
SCHEMBL21889142 0.76 ALDH1A1 (0.39) IRAK4IL1BNLRP3BUB1NUDT1
SCHEMBL30931701 0.76 LOXL2 (0.55) LOXL2
SCHEMBL17371932 0.76 IDH1 (0.41) IRAK4IDH1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 WO disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB IRAK4 13/4885IL1B 82/4885NLRP3 400/4885

“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.