SCHEMBL24702129

SCHEMBL24702129

COc1cccc2c1CCN(C(C)(C)C)CC2

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.55
DRD3 P35462 4/20 0.55
DRD1 P21728 1/20 0.55
DRD5 P21918 1/20 0.55
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
ABHD6 Q9BV23 1/20 0.45
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM3 P20309 2/20 0.44
DRD4 P21917 2/20 0.43
NOTUM Q6P988 1/20 0.43

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
SCHEMBL23774171 0.89 ABHD6 (0.50) DRD2DRD3DRD1DRD5ABHD6
SCHEMBL23976082 0.83 DRD1 (0.76) DRD2DRD3DRD1DRD5HDAC1
SCHEMBL23975696 0.80 DRD2 (0.62) DRD2DRD3DRD1DRD5HDAC1
SCHEMBL25943620 0.80 DRD2 (0.58) DRD2DRD3DRD1DRD5HDAC1
SCHEMBL24702156 0.77 DRD2 (0.55) DRD2DRD3DRD1DRD5HDAC1
SCHEMBL26727552 0.77 ABHD6 (0.47) DRD2DRD3DRD1DRD5ABHD6
SCHEMBL19133719 0.77 DRD2 (0.58) DRD2DRD3DRD1DRD5CHRM2
Ammonia Solution, Strong SCHEMBL7667257 0.75 DRD2 (0.56) DRD2DRD3DRD1DRD5CHRM2
SCHEMBL12558561 0.74 DRD2 (0.52) DRD2DRD3DRD1DRD5CHRM2
SCHEMBL25923527 0.74 ADRA2A (0.40) DRD2DRD3ADRA2AADRA2BADRA2C

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-11746100-B2 Cycloalkyl pyrimidines as ferroportin inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
US-11746100-B2 Cycloalkyl pyrimidines as ferroportin inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
US-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-07-20 US disclosed
US-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-07-20 US disclosed
US-20220396562-A1 CYCLOALKYL PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2022-12-15 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 (3 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-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS SLC40A1, HAMP, SLC19A1 DRD2 3875/4885DRD3 4187/4885DRD1 3812/4885
US-11746100-B2 Cycloalkyl pyrimidines as ferroportin inhibitors HAMP, SLC40A1, FANCI DRD2 3430/4885DRD3 3581/4885DRD1 3093/4885
US-20220396562-A1 CYCLOALKYL PYRIMIDINES AS FERROPORTIN INHIBITORS HAMP, SLC40A1, FANCI DRD2 3430/4885DRD3 3581/4885DRD1 3093/4885

“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.