SCHEMBL24253320

SCHEMBL24253320

CC(C)c1ccc2c(c1)CCN(C(C)CCC(C)c1ccc3c(c1)CCN(C)CC3)CC2

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.38
ALDH1A1 P00352 1/20 0.37
DRD1 P21728 7/20 0.36
DRD5 P21918 7/20 0.36
DRD2 P14416 5/20 0.36
DRD3 P35462 5/20 0.36
DRD4 P21917 4/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL20353868 0.85 HRH3 (0.43) HRH3
SCHEMBL26227089 0.82 DRD1 (0.47) HRH3DRD1DRD5DRD2DRD3
SCHEMBL12628112 0.78 MAOA (0.55) DRD1DRD5DRD2DRD3DRD4
SCHEMBL1619374 0.76 MAOA (0.52) ALDH1A1DRD1DRD5DRD2DRD3
SCHEMBL24931549 0.75 KCNH2 (0.38) HRH3DRD2DRD3
SCHEMBL21362950 0.74 HRH3 (0.46) HRH3DRD1DRD5DRD2DRD3
SCHEMBL25085601 0.74 TMEM97 (0.38) HRH3
SCHEMBL2741634 0.70 OGA (0.43) HRH3ALDH1A1
SCHEMBL10199349 0.70 HRH3 (0.48) HRH3ALDH1A1
SCHEMBL25814865 0.70 DRD2 (0.51) HRH3DRD1DRD5DRD2DRD4

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
US-20230250080-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2023-08-10 US disclosed
US-11613527-B2 Enzyme inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2023-03-28 US disclosed
US-20220048894-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-02-17 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-20230250080-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 HRH3 442/4885ALDH1A1 1622/4885DRD1 4401/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 HRH3 442/4885ALDH1A1 1622/4885DRD1 4401/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 HRH3 442/4885ALDH1A1 1622/4885DRD1 4401/4885

“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.