SCHEMBL6460844

SCHEMBL6460844

COc1ccc(-c2ccn(-c3ccccn3)n2)c(O)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TP53 P04637 2/20 0.43
TUBB4A P04350 2/20 0.41
TUBB P07437 2/20 0.41
TUBA3C P0DPH7 2/20 0.41
TUBA1B P68363 2/20 0.41
TUBA4A P68366 2/20 0.41
TUBB4B P68371 2/20 0.41
TUBB3 Q13509 2/20 0.41
TUBB2A Q13885 2/20 0.41
TUBB8 Q3ZCM7 2/20 0.41
TUBA3E Q6PEY2 2/20 0.41
TUBA1A Q71U36 2/20 0.41
TUBA1C Q9BQE3 2/20 0.41

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
SCHEMBL7049088 0.82 GRM5 (0.45) ALDH1A1RAB9AKDM4EHPGDHSD17B10
SCHEMBL6453926 0.82 LMNA (0.37) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6448665 0.82 PDCD1 (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL3926024 0.79 SYK (0.45) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6448695 0.79 MAPT (0.50) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6449004 0.76 GRM5 (0.50) ALDH1A1NPC1RAB9AKDM4EHPGD
SCHEMBL6449917 0.76 MAPT (0.50) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6448429 0.72 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6452303 0.72 CHRNA7 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6530306 0.71 SYK (0.47) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E

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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC ALDH1A1 287/4885SMN1; SMN2 4633/4885NPC1 59/4885

“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.