SCHEMBL21536626

SCHEMBL21536626

O=C1CN(Cc2ccc3c(c2)CCN3S(=O)(=O)c2cccc(OC3CCCC3)c2)C(=O)N1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 4/20 0.44
▸ CYP11B2 P19099 4/20 0.44
▸ KDM1A O60341 3/20 0.41
▸ KDM1B Q8NB78 3/20 0.41
▸ MAOA P21397 2/20 0.41
▸ HTR6 P50406 5/20 0.40
▸ DRD3 P35462 8/20 0.39
▸ HRH3 Q9Y5N1 3/20 0.39
▸ DUT P33316 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ DRD2 P14416 1/20 0.36

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
SCHEMBL23996254 0.90 KDM1A (0.42) CYP11B1CYP11B2KDM1AKDM1BMAOA
SCHEMBL21536693 0.85 DUT (0.41) HTR6DRD3HRH3DUTKCNH2
SCHEMBL24153550 0.81 BACE1 (0.33) DUTDRD2
SCHEMBL21536692 0.79 HTR6 (0.46) HTR6DUT
SCHEMBL20189396 0.77 DUT (0.49) DUTMAPTSMN1; SMN2
SCHEMBL21536743 0.75 DUT (0.47) DUT
SCHEMBL21536095 0.74 DUT (0.46) KDM1ADUTDRD2
SCHEMBL21536091 0.74 DUT (0.47) DUT
SCHEMBL21536086 0.74 DUT (0.47) DUT
SCHEMBL21536622 0.74 DUT (0.47) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263773-A1 COMBINATION THERAPY WITH DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2023-08-24 — — US disclosed
US-20230263773-A1 COMBINATION THERAPY WITH DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2023-08-24 — — US disclosed
US-11168059-B2 Amino sulfonyl compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-09 — — US disclosed
US-20190330158-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 — — 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-20230263773-A1 COMBINATION THERAPY WITH DEOXYURIDINE TRIPHOSPHATASE INHIBITORS TYMP, DUT, TYMS CYP11B1 3145/4885CYP11B2 3039/4885KDM1A 1839/4885
US-11168059-B2 Amino sulfonyl compounds DPYD, DNPEP, DUT CYP11B1 3478/4885CYP11B2 3782/4885KDM1A 1148/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT CYP11B1 3478/4885CYP11B2 3782/4885KDM1A 1148/4885

“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.

Send feedback