SCHEMBL17974025

SCHEMBL17974025

Cc1cccc(S(=O)(=O)N2CCN(c3ccc(/C=C/c4cc(Cl)cc(Cn5ccnc5)c4)cc3)CC2)c1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 20/20 0.79
CYP11B1 P15538 20/20 0.79
CYP21A2 P08686 19/20 0.79
CYP3A4 P08684 2/20 0.75
CYP19A1 P11511 1/20 0.75
CYP7A1 P22680 1/20 0.75

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
SCHEMBL17959132 0.88 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959134 0.88 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959104 0.88 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959103 0.88 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959148 0.87 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17923050 0.87 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17923053 0.86 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959089 0.86 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17959098 0.85 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1
SCHEMBL17923063 0.85 CYP17A1 (1.00) CYP17A1CYP11B1CYP21A2CYP3A4CYP19A1

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-9725436-B2 Cytochrome P450 inhibitors and their method of use CORTENDO AB (PUBL) (US) 2017-08-08 US disclosed
US-20160221990-A1 NOVEL CYTOCHROME P450 INHIBITORS AND THEIR METHOD OF USE HAYFIN SERVICES LLP (GB) 2016-08-04 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-20160221990-A1 NOVEL CYTOCHROME P450 INHIBITORS AND THEIR METHOD OF USE CYP11B1, CYP11B2, CYP21A2 CYP17A1 6/4885CYP11B1 1/4885CYP21A2 3/4885

“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.