SCHEMBL25969333

SCHEMBL25969333

CCOC(=O)CCCC(C)c1ccc(CBr)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.43
CYP4A11 Q02928 3/20 0.43
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP4Z1 Q86W10 2/20 0.40
CYP4F11 Q9HBI6 1/20 0.40
CYP4F12 Q9HCS2 1/20 0.40
CYP1A2 P05177 1/20 0.39
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX5 P09917 1/20 0.38
ALOX15 P16050 1/20 0.37
LTA4H P09960 2/20 0.37
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7708867 0.82 CYP3A4 (0.53) CYP4F2CYP4A11TDP1CYP1A2CYP3A4
SCHEMBL8902332 0.82 ALOX15 (0.55) TDP1MEN1KMT2ACYP1A2ALOX15
SCHEMBL5962655 0.80 NAMPT (0.41) CYP4F2CYP4A11TDP1MEN1KMT2A
SCHEMBL1206362 0.80 CYP4F2 (0.47) CYP4F2CYP4A11TDP1MEN1KMT2A
Iophendylate SCHEMBL492663 0.78 CYP4F2 (0.42) CYP4F2CYP4A11TDP1MEN1KMT2A
SCHEMBL18713430 0.77 ALOX5 (0.54) CYP4F2CYP4A11TDP1MEN1KMT2A
SCHEMBL8997181 0.76 L3MBTL1 (0.41) CYP4F2CYP4A11TDP1MEN1KMT2A
SCHEMBL4887611 0.76 CYP4F2 (0.72) CYP4F2CYP4A11TDP1CYP4Z1CYP4F11
SCHEMBL30257467 0.75 LTA4H (0.56) LTA4H
SCHEMBL9870605 0.75 KMT2A (0.46) CYP4F2CYP4A11TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 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-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 CYP4F2 4757/4885CYP4A11 3888/4885TDP1 74/4885

“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.