SCHEMBL8264459

SCHEMBL8264459

COc1cccc(-c2ccc(OCc3ccccc3)c(CNc3cccnc3N)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 7/20 0.66
▸ ALDH1A1 P00352 4/20 0.46
▸ LMNA P02545 4/20 0.46
▸ CYP1A2 P05177 4/20 0.46
▸ CYP3A4 P08684 4/20 0.46
▸ CYP2D6 P10635 4/20 0.46
▸ MAPK1 P28482 4/20 0.46
▸ CYP2C19 P33261 4/20 0.46
▸ ALOX15 P16050 3/20 0.46
▸ TSHR P16473 3/20 0.46
▸ CYP2C9 P11712 3/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ CLK4 Q9HAZ1 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ USP2 O75604 2/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ ABCB1 P08183 3/20 0.45
▸ HTR1A P08908 2/20 0.45
▸ DRD2 P14416 2/20 0.45

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
SCHEMBL8264480 0.90 BACE1 (0.66) BACE1ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL14007526 0.85 BACE1 (0.69) BACE1ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL4934632 0.82 BACE1 (0.59) BACE1ALDH1A1LMNAMAPK1ALOX15
SCHEMBL8264446 0.79 BACE1 (0.63) BACE1ALDH1A1LMNANPC1RAB9A
SCHEMBL8264955 0.79 BACE1 (1.00) BACE1LTA4HMAPK14
SCHEMBL5215267 0.79 ABCB1 (0.47) BACE1ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL8264992 0.79 BACE1 (0.60) BACE1ALDH1A1LMNARAB9ALTA4H
SCHEMBL14007505 0.76 BACE1 (0.68) BACE1ALDH1A1LMNACLK4KMT2A
SCHEMBL14007501 0.76 BACE1 (0.68) BACE1ALDH1A1LMNAMAPK1MEN1
SCHEMBL8263987 0.74 DHFR (0.48) ALDH1A1LMNACYP1A2CYP3A4CYP2D6

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 30/4885ALDH1A1 1429/4885LMNA 2965/4885

“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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