SCHEMBL3011371

SCHEMBL3011371

CC(C)(C)OC(=O)N1CCc2cc(C#C[Si](C)(C)C)ccc2C1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.63
NR1H2 P55055 1/20 0.56
GABRG2 P18507 4/20 0.43
GABRB3 P28472 4/20 0.43
GABRA5 P31644 4/20 0.43
GABRA1 P14867 3/20 0.43
GABRA3 P34903 3/20 0.43
GABRA2 P47869 3/20 0.43
GABRA6 Q16445 3/20 0.43
GABRA4 P48169 3/20 0.43
GABRB2 P47870 1/20 0.43
ABHD6 Q9BV23 2/20 0.43
ESR1 P03372 2/20 0.42
MAPK1 P28482 1/20 0.42
GRM5 P41594 2/20 0.41
HDAC1 Q13547 1/20 0.41
MAPT P10636 2/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
JAK2 O60674 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
SCHEMBL4590083 0.95 NR1H2 (0.62) ESR2NR1H2GABRG2GABRB3GABRA5
SCHEMBL451998 0.83 ESR2 (0.69) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL30409090 0.83 ESR2 (0.69) ESR2NR1H2GABRG2GABRB3GABRA5
SCHEMBL30548176 0.83 ESR2 (0.69) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL3009208 0.83 ESR2 (0.69) ESR2NR1H2GABRG2GABRB3GABRA5
SCHEMBL20568944 0.82 ESR2 (0.61) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL3009981 0.82 MAPT (0.48) ESR2NR1H2GABRG2GABRB3GABRA5
SCHEMBL21747817 0.81 CHRM4 (0.48) ESR2NR1H2GABRG2GABRB3GABRA5
SCHEMBL24676283 0.80 NR1H2 (0.62) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL2416879 0.79 NR1H2 (0.67) ESR2NR1H2MAPK1HDAC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713096-A1 CDK INHIBITOR COMPOUNDS Aleksia Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024238574-A1 CDK INHIBITOR COMPOUNDS ALEKSIA THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed
US-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-05 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-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds MCHR1, MCHR2, MC5R ESR2 699/4885NR1H2 842/4885GABRG2 617/4885

“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.