SCHEMBL22845477

SCHEMBL22845477

CC(C)(C)OC(=O)N1CCc2c(n3nccc3n(Cc3ccccc3)c2=O)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 4/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TP53 P04637 3/20 0.40
LMNA P02545 1/20 0.40
ENPP2 Q13822 3/20 0.39
DPP4 P27487 1/20 0.39
PRKCI P41743 1/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BRD4 O60885 1/20 0.39
MAPK1 P28482 1/20 0.38

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
SCHEMBL22718494 0.90 P2RX3 (0.47) P2RX3HDAC1HDAC6ALDH1A1TP53
SCHEMBL22845499 0.82 NR1H2 (0.43) P2RX3MAPK1
SCHEMBL22845402 0.79 P2RX3 (0.43) P2RX3HDAC1HDAC6TP53
SCHEMBL22717352 0.79 CLPP (0.46) HDAC1HDAC6TP53
SCHEMBL13249772 0.77 P2RX3 (0.49) P2RX3HDAC1HDAC6OPRD1OPRK1
SCHEMBL24914777 0.76 ENPP2 (0.54) P2RX3HDAC1HDAC6ENPP2
SCHEMBL6421345 0.75 HDAC1 (0.67) HDAC1HDAC6
SCHEMBL22717413 0.74 KDM1A (0.47) P2RX3HDAC1HDAC6ALDH1A1TP53
SCHEMBL22830643 0.74 MAPT (0.44) HDAC1HDAC6TP53LMNASMN1; SMN2
SCHEMBL29676939 0.74 MAPT (0.44) HDAC1HDAC6TP53LMNASMN1; SMN2

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-20220000874-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-01-06 US disclosed
US-11136321-B2 Tricyclic compounds ALIGOS THERAPEUTICS, INC. (US) 2021-10-05 US disclosed
US-20200407361-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2020-12-31 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 (3 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-20220000874-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL P2RX3 3237/4885HDAC1 47/4885HDAC6 12/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL P2RX3 3237/4885HDAC1 47/4885HDAC6 12/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL P2RX3 3237/4885HDAC1 47/4885HDAC6 12/4885

“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.