SCHEMBL24854091

SCHEMBL24854091

COCCN1CCC2(CC1)CCN(C(C)(C)C)C2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC1 Q13547 1/20 0.33
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
ALOX15 P16050 1/20 0.31
CNR2 P34972 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
SCHEMBL24854089 0.92 HDAC2 (0.34) HSD11B1HDAC2HDAC1DRD2DRD3
SCHEMBL21472213 0.92 HSD11B1 (0.34) HSD11B1HDAC2HDAC1DRD2DRD3
SCHEMBL24854080 0.90 HDAC2 (0.37) HSD11B1HDAC2HDAC1DRD2DRD3
SCHEMBL24854220 0.90 HDAC2 (0.31) HSD11B1HDAC2HDAC1CNR2
SCHEMBL24854090 0.90 CYP2D6 (0.36) HSD11B1DRD2DRD3CYP1A2CYP2D6
SCHEMBL24854270 0.87 HDAC2 (0.35) HSD11B1HDAC2HDAC1DRD2DRD3
SCHEMBL24854099 0.85 GRIN2D (0.32) HSD11B1HDAC2HDAC1CYP1A2CNR2
SCHEMBL24854291 0.82 CYP1A2 (0.36) DRD2DRD3CYP1A2CYP2D6ALOX15
SCHEMBL24855098 0.81
SCHEMBL24856292 0.79 KCNH2 (0.33) CYP1A2CYP2D6ALOX15

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-20230002382-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUNDS Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-01-05 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-20230002382-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUNDS KRAS, NRAS, HRAS HSD11B1 1515/4885HDAC2 1985/4885HDAC1 1440/4885

“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.