SCHEMBL30165632

SCHEMBL30165632

CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.54
SIGMAR1 Q99720 3/20 0.53
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HRH3 Q9Y5N1 11/20 0.48
KCNA5 P22460 1/20 0.47
HRH2 P25021 1/20 0.47
HRH1 P35367 1/20 0.47

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
SCHEMBL19692572 0.89 SIGMAR1 (0.56) LTA4HSIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL19692548 0.88 ALDH1A1 (0.58) SIGMAR1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL19692561 0.80 SIGMAR1 (0.56) LTA4HSIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL19692624 0.78 ALDH1A1 (0.57) SIGMAR1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL28285423 0.77 SIGMAR1 (0.64) LTA4HSIGMAR1HRH3
SCHEMBL25537466 0.77 SIGMAR1 (0.52) SIGMAR1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL19692518 0.76 ALDH1A1 (0.57) SIGMAR1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL25539990 0.74 KCNA5 (0.53) SIGMAR1MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL5709509 0.74 SIGMAR1 (0.54) LTA4HSIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL3596798 0.74 HTR1A (0.63) LTA4HSIGMAR1MEN1ALDH1A1KMT2A

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-11547704-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-01-10 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-11547704-B2 Chemical compounds ATF4, XBP1, EIF2B5 LTA4H 2707/4885SIGMAR1 831/4885MEN1 2251/4885

“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.