SCHEMBL4937660

SCHEMBL4937660

COc1ccc(-c2cccc(CCc3cccc(N)n3)c2)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.73
NOS1 P29475 3/20 0.45
NOS2 P35228 2/20 0.45
CYP19A1 P11511 1/20 0.44
F9 P00740 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
FYN P06241 2/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
ADORA1 P30542 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DHFR P00374 1/20 0.40
NOS3 P29474 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL4941238 0.84 BACE1 (1.00) BACE1NOS1NOS2ADORA1DHFR
SCHEMBL4935392 0.79 BACE1 (0.80) BACE1NOS1NOS2FYNDHFR
SCHEMBL4141609 0.78 BACE1 (0.77) BACE1
SCHEMBL4938657 0.75 BACE1 (0.62) BACE1NOS1NOS2CYP19A1MEN1
SCHEMBL4937000 0.73 BACE1 (0.79) BACE1NOS1NOS2ADORA1NOS3
SCHEMBL9287916 0.73 BCL2 (0.50) L3MBTL1FYNLMNAMAPK1MEN1
SCHEMBL23201194 0.71 CA2 (0.69) L3MBTL1LMNAMEN1KMT2AKDM4E
SCHEMBL2932096 0.71 CYP4F2 (0.48) L3MBTL1FYNLMNAMAPK1MEN1
SCHEMBL4937900 0.71 BACE1 (0.61) BACE1NOS1NOS2ADORA1
SCHEMBL8989813 0.70 KCNH2 (0.73) BACE1NOS1NOS2DHFRNOS3

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 5 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 claimed
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
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 30/4885NOS1 269/4885NOS2 253/4885

“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.