SCHEMBL22845278

SCHEMBL22845278

CNC(=O)c1ccc(-n2c(=O)c3c(n4ncc(NCc5ccccc5F)c24)CN(C(=O)c2ccc(Br)c(C#N)c2)CC3)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.32
GRM1 Q13255 8/20 0.32
PTK2 Q05397 1/20 0.32
KCNK3 O14649 1/20 0.31
MAPK14 Q16539 1/20 0.31
USP7 Q93009 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL22845373 0.92 TP53 (0.35) PTK2MAPK14LMNAHPGD
SCHEMBL24173941 0.92 GRM1 (0.39) GRM5GRM1USP7
SCHEMBL22845431 0.90 GRM5 (0.38) GRM5GRM1
SCHEMBL22845201 0.86 S1PR2 (0.33) GRM1MAPK14USP7
SCHEMBL22845502 0.86 GRM1 (0.34) GRM5GRM1USP7
SCHEMBL22845357 0.85 PRLHR (0.35)
SCHEMBL22845442 0.84 GRM5 (0.34) GRM5GRM1MAPK14
SCHEMBL22845531 0.84 MAPK14 (0.35) GRM5KCNK3MAPK14
SCHEMBL22845388 0.83 PREP (0.35) GRM1MAPK14
SCHEMBL22845318 0.83 PRLHR (0.33) GRM5GRM1

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 GRM5 3636/4885GRM1 4264/4885PTK2 4823/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL GRM5 3636/4885GRM1 4264/4885PTK2 4823/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL GRM5 3636/4885GRM1 4264/4885PTK2 4823/4885

“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.