SCHEMBL26170486

SCHEMBL26170486

CC(C)(C)OC(=O)Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(S(C)(=N)=O)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.42
RORC P51449 4/20 0.42
HDAC1 Q13547 5/20 0.41
KCNQ4 P56696 3/20 0.39
KCNQ5 Q9NR82 3/20 0.39
HDAC2 Q92769 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HDAC3 O15379 2/20 0.36
KCNH2 Q12809 1/20 0.36
KDM1A O60341 1/20 0.36
MMP8 P22894 2/20 0.36
MMP3 P08254 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
SCHEMBL25221573 0.90 RORC (0.41) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL26170484 0.85 CYP17A1 (0.48) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25214971 0.84 CYP17A1 (0.46) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25254806 0.82 HDAC2 (0.58) HDAC1HDAC2HDAC3KCNH2
SCHEMBL25218254 0.81 HDAC1 (0.45) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25255025 0.81 CYP17A1 (0.43) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25211166 0.81 CYP17A1 (0.43) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25256259 0.81 CYP17A1 (0.43) CYP17A1RORCHDAC1KCNQ4KCNQ5
SCHEMBL25224795 0.80 CYP17A1 (0.45) CYP17A1HDAC1KCNQ4KCNQ5HDAC2
SCHEMBL1705492 0.80 HDAC1 (0.51) CYP17A1HDAC1KCNQ4KCNQ5HDAC2

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-12043607-B2 HDAC inhibitors and therapeutic use thereof TANGO THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-20230174501-A1 NOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. 2023-06-08 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-20230174501-A1 NOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF HDAC1, HDAC7, HDAC5 CYP17A1 1294/4885RORC 663/4885HDAC1 1/4885
US-12043607-B2 HDAC inhibitors and therapeutic use thereof HDAC1, HDAC7, HDAC5 CYP17A1 657/4885RORC 699/4885HDAC1 1/4885

“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.