SCHEMBL4939736

SCHEMBL4939736

COc1ccc(-c2cccc(CC3(N)C=CC=NC3N)c2)cc1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 4/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ TLR8 Q9NR97 2/20 0.34
▸ TLR7 Q9NYK1 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL4937909 0.86 BACE1 (0.43) ALDH1A1TSHRBACE1LMNAMAPK1
SCHEMBL4938118 0.83 AGXT (0.42) KDM1AMAOABACE1
SCHEMBL4939325 0.82 BACE1 (0.45) FYNBACE1
SCHEMBL4931182 0.79 BACE1 (0.38) BACE1
SCHEMBL4939691 0.78 ABCB1 (0.43) KDM4EHSD17B10ALDH1A1TSHRMAPT
SCHEMBL4933092 0.78 EPHX2 (0.44) KDM1AALDH1A1BACE1
SCHEMBL4941227 0.76 BACE1 (0.44) NPC1KDM1AMAOABACE1
SCHEMBL4935935 0.76 HSD17B10 (0.37) NPC1RAB9AHSD17B10MAPTSMN1; SMN2
SCHEMBL4938110 0.74 IDO1 (0.38) RAB9AKDM1AMAOATSHRLMNA
SCHEMBL20553211 0.73 MAOA (0.39) KDM1AMAOA

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 2 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

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 FYN 1008/4885NPC1 512/4885RAB9A 1387/4885

“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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