SCHEMBL22845403

SCHEMBL22845403

CCOC(=O)c1cnn2c3c(c(=O)n(-c4ccccc4)c12)CCN(Cc1ccc(OC)c(OC)c1)C3

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.45
LMNA P02545 3/20 0.42
GNRHR P30968 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
FAAH O00519 1/20 0.40
MAPT P10636 3/20 0.40
ADORA1 P30542 1/20 0.40
POLB P06746 1/20 0.39
THRB P10828 1/20 0.39
ACHE P22303 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL22845204 0.89 GNRHR (0.44) TP53GNRHRMEN1KMT2AFAAH
SCHEMBL22845483 0.83 GNRHR (0.44) TP53GNRHRMEN1KMT2AFAAH
SCHEMBL22845227 0.83 GNRHR (0.44) TP53GNRHRMEN1KMT2AMAPT
SCHEMBL22845269 0.79 GNRHR (0.43) TP53LMNAGNRHRMEN1KMT2A
SCHEMBL22845374 0.79 GNRHR (0.45) GNRHRMEN1KMT2AMAPTACHE
SCHEMBL22845396 0.78 GNRHR (0.44) GNRHRMEN1KMT2AMAPTACHE
SCHEMBL22845409 0.75 TSHR (0.40) TP53LMNAMAPTPOLBALDH1A1
SCHEMBL22845489 0.75 GNRHR (0.44) LMNAGNRHRMEN1KMT2AMAPT
SCHEMBL22845408 0.74 ALDH1A1 (0.43) KMT2AMAPTALDH1A1
SCHEMBL22845307 0.71 CLPP (0.47) LMNAGNRHRMEN1KMT2AMAPT

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 TP53 1710/4885LMNA 1680/4885GNRHR 2198/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL TP53 1710/4885LMNA 1680/4885GNRHR 2198/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL TP53 1710/4885LMNA 1680/4885GNRHR 2198/4885

“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.