SCHEMBL22101455

SCHEMBL22101455

CC(C)(C)OC(=O)Nc1cc(F)c2nc(C(F)F)cc(=O)n2c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.36
RORC P51449 4/20 0.35
SYK P43405 1/20 0.35
BRD4 O60885 2/20 0.34
EGLN2 Q96KS0 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
PSMB8 P28062 1/20 0.33
PIK3CB P42338 2/20 0.33
PRKDC P78527 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
CYP17A1 P05093 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CG P48736 1/20 0.32

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
SCHEMBL22101413 0.83 MAPKAPK2 (0.37) P2RX3SYKBRD4EGLN2CA12
SCHEMBL22101442 0.77 P2RX3 (0.37) P2RX3RORCSYKBRD4EGLN2
SCHEMBL22101865 0.76 KCNQ3 (0.31) PIK3CB
SCHEMBL23608697 0.74 SYK (0.39) SYKEGLN2CA12CA1CA9
SCHEMBL22393588 0.74 KCNQ3 (0.36)
SCHEMBL22101522 0.72 PIK3CB (0.37) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL22101697 0.70 KCNQ3 (0.34) PIK3CB
SCHEMBL25839112 0.69 CYP17A1 (0.38) SYKEGLN2CA12CA1CA9
SCHEMBL30013712 0.69 CYP17A1 (0.38) SYKEGLN2CA12CA1CA9
SCHEMBL22101486 0.69 KCNQ3 (0.35)

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-20230035184-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-02-02 US disclosed
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-05-17 US disclosed
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2020-09-03 US disclosed
EP-3666772-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2020-06-17 EP 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-20230035184-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR P2RX3 2446/4885RORC 194/4885SYK 4296/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR P2RX3 2446/4885RORC 194/4885SYK 4296/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR P2RX3 2446/4885RORC 194/4885SYK 4296/4885

“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.