SCHEMBL10250511

SCHEMBL10250511

Cc1cccc(C2CCc3nc(-c4cccc[n+]4[O-])oc3C2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.35
HTR2C P28335 2/20 0.34
DRD4 P21917 3/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
MAOB P27338 1/20 0.31
ADRA1A P35348 2/20 0.31
MAPT P10636 2/20 0.31
ALOX15B O15296 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 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
SCHEMBL505398 0.85 GRM5 (0.36) GPR119DRD4DRD2DRD3NPSR1
SCHEMBL10250286 0.78 KDM4E (0.44) GPR119HTR2CNPC1RAB9ASMN1; SMN2
SCHEMBL10250335 0.78 GPR119 (0.42) GPR119HTR2CADRA1AMAPTALOX15B
SCHEMBL10250130 0.77 HTR2C (0.36) GPR119HTR2CDRD4DRD2DRD1
SCHEMBL10250358 0.76 GRM5 (0.42) GPR119HTR2CADRA1AMAPTALOX15B
SCHEMBL10250301 0.75 NPC1 (0.45) GPR119HTR2CMAOBMAPTNPC1
SCHEMBL10250519 0.73 RAB9A (0.42) GPR119HTR2CMAOBADRA1AMAPT
SCHEMBL10249981 0.73 GRM5 (0.46) GPR119
SCHEMBL10250745 0.72 CASP3 (0.37) GPR119HTR2CDRD4DRD2DRD1
SCHEMBL10250207 0.72 NPC1 (0.43) HTR2CDRD4DRD2DRD1DRD5

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-20120029190-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2012-02-02 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-20120029190-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF GRM5, GRM2, GRM1 GPR119 94/4885HTR2C 236/4885DRD4 2393/4885

“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.