SCHEMBL24676662

SCHEMBL24676662

COc1ccc2c(c1)CCCOCC2(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.48
DRD1 P21728 8/20 0.43
DRD2 P14416 8/20 0.43
DRD3 P35462 8/20 0.43
DRD5 P21918 7/20 0.43
DRD4 P21917 5/20 0.43
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
METAP1 P53582 2/20 0.38
LMNA P02545 1/20 0.38
BCL2 P10415 1/20 0.37

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
SCHEMBL4640481 0.80 KDM1A (0.61) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL1495858 0.76 KDM1A (0.53) KDM1ADRD1DRD2DRD3DRD5
Hydrochloric Acid SCHEMBL23421993 0.73 KDM1A (0.50) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL14158486 0.73 BACE1 (0.37) DRD1DRD2DRD3DRD5SLC6A2
SCHEMBL31650219 0.71 KDM1A (0.58) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL23421994 0.71 KDM1A (0.48) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL5749365 0.71 KDM1A (0.58) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL29051650 0.70 HTR2C (0.53) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL577378 0.69 DRD1 (0.62) KDM1ADRD1DRD2DRD3DRD5
SCHEMBL31028084 0.69 DRD1 (0.62) DRD1DRD2DRD3DRD5DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142119-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-11 US disclosed
US-20220306578-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-09-29 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 (2 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-20230142119-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 KDM1A 1270/4885DRD1 1227/4885DRD2 1561/4885
US-20220306578-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 KDM1A 1270/4885DRD1 1227/4885DRD2 1561/4885

“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.