SCHEMBL22101447

SCHEMBL22101447

CCc1cc(=O)n2cc(NC(C)(C)C#N)cc(F)c2n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 6/20 0.33
BCAT1 P54687 2/20 0.33
MAT2A P31153 1/20 0.30
CXCR2 P25025 1/20 0.30

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
SCHEMBL22101439 0.83
SCHEMBL22101865 0.82 KCNQ3 (0.31)
SCHEMBL22101360 0.82 MAPT (0.35) MAT2ACXCR2
SCHEMBL22101361 0.80 KDM4E (0.34) MAT2ACXCR2
SCHEMBL22101413 0.76 MAPKAPK2 (0.37)
SCHEMBL22393704 0.75 MAPT (0.36) MAT2ACXCR2
SCHEMBL22101400 0.73 CXCR2 (0.38) BCAT2BCAT1MAT2ACXCR2
SCHEMBL22101725 0.73 GRIN1 (0.40) MAT2ACXCR2
SCHEMBL22393919 0.72 KDM5B (0.36) BCAT2MAT2ACXCR2
SCHEMBL22101411 0.72 KDM5B (0.36) BCAT2MAT2ACXCR2

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 5 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-20220009925-A1 CRYSTAL OF DIARYLTHIOHYDANTOIN COMPOUND CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-01-13 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 (4 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 BCAT2 758/4885BCAT1 838/4885MAT2A 1257/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR BCAT2 758/4885BCAT1 838/4885MAT2A 1257/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR BCAT2 758/4885BCAT1 838/4885MAT2A 1257/4885
US-20220009925-A1 CRYSTAL OF DIARYLTHIOHYDANTOIN COMPOUND SHBG, NR5A1, CYP21A2 BCAT2 436/4885BCAT1 718/4885MAT2A 920/4885

“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.