SCHEMBL8264992

SCHEMBL8264992

CC(C)(C)c1ccc(OCc2ccccc2)c(CNc2cccnc2N)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.60
▸ LTA4H P09960 1/20 0.48
▸ MAPK14 Q16539 1/20 0.48
▸ CCR5 P51681 3/20 0.42
▸ LMNA P02545 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ MRGPRX1 Q96LB2 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ STAT3 P40763 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SLC40A1 Q9NP59 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39

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
SCHEMBL8264446 0.84 BACE1 (0.63) BACE1LTA4HMAPK14CCR5LMNA
SCHEMBL14007526 0.79 BACE1 (0.69) BACE1LTA4HMAPK14LMNAALDH1A1
SCHEMBL8264459 0.79 BACE1 (0.66) BACE1LTA4HMAPK14LMNAALDH1A1
SCHEMBL5215584 0.77 LTA4H (0.45) LTA4HMAPK14MRGPRX1MRGPRX4
SCHEMBL8264955 0.75 BACE1 (1.00) BACE1LTA4HMAPK14CCR5MRGPRX1
SCHEMBL14007515 0.74 MEN1 (0.53) BACE1CCR5ALDH1A1HTTSMN1; SMN2
SCHEMBL20147117 0.74 MRGPRX4 (0.53) CCR5LMNAALDH1A1SMN1; SMN2RAB9A
SCHEMBL8265027 0.73 BACE1 (0.52) BACE1LTA4HMAPK14CCR5LMNA
SCHEMBL769497 0.72 RXRA (0.50) CCR5LMNAMAOBALDH1A1RAB9A
SCHEMBL768907 0.72 MRGPRX4 (0.52) CCR5LMNAMAOBHTTRAB9A

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-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US disclosed
US-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US disclosed
WO-2006065204-A1 SUBSTITUTED AMINOPYRIDINES AND USES THEREOF ASTRAZENECA AB (SE) 2006-06-22 — — 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-20080287399-A1 Substituted Aminopyridines and Uses Thereof PSEN2, SLC1A2, PSEN1 BACE1 30/4885LTA4H 1470/4885MAPK14 1589/4885

“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.

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