SCHEMBL22393602

SCHEMBL22393602

COC(=O)c1ccc(Nc2c(C)ccnc2Nc2ccc(C#N)c(C(F)(F)F)c2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.44
KDR P35968 4/20 0.44
BRAF P15056 2/20 0.44
TRPV1 Q8NER1 1/20 0.43
EGFR P00533 2/20 0.42
ERBB2 P04626 1/20 0.42
AR P10275 6/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL22101261 0.84 TAS2R14 (0.54) TAS2R14KDRBRAFTRPV1AR
SCHEMBL22101389 0.78 EGFR (0.41) KDRBRAFEGFRERBB2AR
SCHEMBL22101448 0.75 EGFR (0.39) KDRBRAFEGFRERBB2AR
SCHEMBL22101200 0.75 ATR (0.44) TRPV1EGFRKDM4EMAPT
SCHEMBL22393849 0.75 ABCG2 (0.35) TAS2R14KDRBRAFEGFRAR
SCHEMBL22101280 0.74 TAS2R14 (0.52) TAS2R14KDRBRAFTRPV1AR
SCHEMBL22101890 0.74 ABCG2 (0.41) TAS2R14KDRBRAFEGFRERBB2
SCHEMBL22101880 0.72 AR (0.41) TAS2R14BRAFEGFRERBB2AR
SCHEMBL22101726 0.71 AR (0.49) AR
SCHEMBL15635906 0.69 GRM4 (0.52) EGFRCYP2D6CYP2C9CYP2C19MAPT

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 3 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

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 TAS2R14 3043/4885KDR 618/4885BRAF 3180/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR TAS2R14 3043/4885KDR 618/4885BRAF 3180/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR TAS2R14 3043/4885KDR 618/4885BRAF 3180/4885

“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.