SCHEMBL26160495

SCHEMBL26160495

Cc1c(OC(c2ccc([C@H](N)O)cc2)c2cccc(C#N)c2)ccc2c1OCCC2=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.40
MRGPRX4 Q96LA9 1/20 0.34
TNF P01375 1/20 0.32
MAOB P27338 3/20 0.32
MAOA P21397 1/20 0.32
GRM4 Q14833 1/20 0.30
KCNJ1 P48048 1/20 0.30
STK10 O94804 2/20 0.30
SLK Q9H2G2 2/20 0.30
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 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
SCHEMBL26160500 1.00 GRM5 (0.40) GRM5MRGPRX4TNFMAOBMAOA
SCHEMBL26160482 0.91 MAOB (0.37) GRM5MAOBLTB4RLTB4R2
SCHEMBL26160493 0.91 MAOB (0.37) GRM5MAOBLTB4RLTB4R2
SCHEMBL26160488 0.91 MAOB (0.37) GRM5MAOBLTB4RLTB4R2
SCHEMBL23905970 0.90 GRM5 (0.39) GRM5MRGPRX4TNFMAOBMAOA
SCHEMBL30251017 0.90 GRM5 (0.39) GRM5MRGPRX4TNFMAOBMAOA
SCHEMBL26159421 0.90 GRM5 (0.39) GRM5MRGPRX4TNFMAOBMAOA
SCHEMBL23882869 0.90 GRM5 (0.39) GRM5MRGPRX4TNFMAOBMAOA
SCHEMBL23906321 0.90 GRM5 (0.39) GRM5TNFMAOBMAOA
SCHEMBL23905983 0.86 MAOB (0.35) GRM5MRGPRX4MAOBLTB4RLTB4R2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230150985-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR JANSSEN PHARMACEUTICA NV (BE) 2023-05-18 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 (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-20230150985-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR HLA-DRB1, CD74, HLA-C GRM5 2303/4885MRGPRX4 124/4885TNF 1090/4885

“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.