SCHEMBL22845442

SCHEMBL22845442

CNC(=O)c1ccc(-n2c(=O)c3c(n4ncc(Cc5ccc(F)cc5)c24)CN(C(=O)c2ccc(Br)c(C#N)c2)CC3)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.34
GRM1 Q13255 5/20 0.33
PRKAA2 P54646 5/20 0.33
PRKAB2 O43741 4/20 0.33
PRKAG1 P54619 4/20 0.33
PRKAA1 Q13131 4/20 0.33
PRKAG3 Q9UGI9 4/20 0.33
PRKAG2 Q9UGJ0 4/20 0.33
PRKAB1 Q9Y478 4/20 0.33
MAPK14 Q16539 1/20 0.33
NR3C1 P04150 1/20 0.33
AR P10275 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
S1PR2 O95136 1/20 0.32

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
SCHEMBL22845502 0.93 GRM1 (0.34) GRM5GRM1AR
SCHEMBL22845335 0.92 GRM5 (0.36) GRM5GRM1PRKAA2PRKAB2PRKAG1
SCHEMBL22845309 0.91 MAPK14 (0.34) PRKAA2MAPK14NR3C1ALDH1A1SMN1; SMN2
SCHEMBL22845431 0.90 GRM5 (0.38) GRM5GRM1PRKAA2PRKAB2PRKAG1
SCHEMBL22845531 0.89 MAPK14 (0.35) GRM5MAPK14
SCHEMBL22845201 0.88 S1PR2 (0.33) GRM1PRKAA2MAPK14ALDH1A1SMN1; SMN2
SCHEMBL22845232 0.87 GRM1 (0.34) GRM5GRM1
SCHEMBL22717403 0.87 AR (0.35) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL22845342 0.87 MAPK14 (0.35) GRM5GRM1MAPK14ALDH1A1SMN1; SMN2
SCHEMBL22845444 0.87 MAPT (0.34) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820773-B2 Tricyclic compounds ALIGOS THERAPEUTICS, INC. (US) 2023-11-21 US disclosed
WO-2022115384-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2022-06-02 WO disclosed
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 (4 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 4264/4885PRKAA2 2338/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL GRM5 3636/4885GRM1 4264/4885PRKAA2 2338/4885
US-11820773-B2 Tricyclic compounds SLC10A1, PKD1, CEL GRM5 3636/4885GRM1 4264/4885PRKAA2 2338/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL GRM5 3636/4885GRM1 4264/4885PRKAA2 2338/4885

“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.