SCHEMBL27358331

SCHEMBL27358331

CC(C)CN1CCC(c2ccc(C(C)C)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.49
SLC18A3 Q16572 3/20 0.48
TLR9 Q9NR96 2/20 0.46
TLR8 Q9NR97 2/20 0.46
TLR7 Q9NYK1 2/20 0.46
NAMPT P43490 1/20 0.46
HPGD P15428 1/20 0.45
PRCP P42785 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
GRM2 Q14416 1/20 0.40

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
SCHEMBL17306126 0.87 SLC18A3 (0.49) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL23374690 0.85 SLC18A3 (0.49) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL14923996 0.85 DRD2 (0.54) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL6247690 0.83 SLC18A3 (0.57) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL1099798 0.83 SLC18A3 (0.67) DRD2SLC18A3GRM2
SCHEMBL20004333 0.81 DRD2 (0.54) DRD2SLC18A3HPGDPRCP
SCHEMBL9347958 0.81 SLC18A3 (0.46) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL23692934 0.81 SLC18A3 (0.64) DRD2SLC18A3TLR9TLR8TLR7
Hydrochloric Acid SCHEMBL9343733 0.80 SLC18A3 (0.44) DRD2SLC18A3TLR9TLR8TLR7
SCHEMBL20883775 0.80 TLR9 (0.48) DRD2SLC18A3TLR9TLR8TLR7

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-20240217947-A1 Morpholinylquinazoline Compound, Pharmaceutical compositions thereof and Use Thereof SHANGHAI YINGLI PHARMACEUTICAL CO., LTD (CN) 2024-07-04 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-20240217947-A1 Morpholinylquinazoline Compound, Pharmaceutical compositions thereof and Use Thereof HDAC6, HDAC9, HDAC7 DRD2 354/4885SLC18A3 3128/4885TLR9 270/4885

“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.