SCHEMBL22101411

SCHEMBL22101411

CCc1cc(=O)n2cc(N)cc(F)c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.36
MAT2A P31153 1/20 0.36
CXCR2 P25025 1/20 0.35
GRIN1 Q05586 3/20 0.34
GRIN2A Q12879 3/20 0.34
GRIA2 P42262 1/20 0.34
MAPT P10636 4/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
BCAT2 O15382 1/20 0.33
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL22101400 0.84 CXCR2 (0.38) KDM5BMAT2ACXCR2GRIN1GRIN2A
SCHEMBL22101725 0.84 GRIN1 (0.40) KDM5BMAT2ACXCR2GRIN1GRIN2A
SCHEMBL22393919 0.82 KDM5B (0.36) KDM5BMAT2ACXCR2GRIN1GRIN2A
SCHEMBL22393704 0.80 MAPT (0.36) KDM5BMAT2ACXCR2GRIN1GRIN2A
SCHEMBL22101435 0.78 TSHR (0.30) TSHRHSD17B10KDM4EALDH1A1HPGD
SCHEMBL31600410 0.75 NOS3 (0.33) NOS3NOS2
SCHEMBL22101454 0.75 KCNQ3 (0.35)
Hydrochloric Acid SCHEMBL31600038 0.74 NOS3 (0.33) NOS3NOS2
SCHEMBL22101360 0.72 MAPT (0.35) MAT2ACXCR2MAPTPOLBTP53
SCHEMBL22101696 0.71 KDM5B (0.39) KDM5BMAT2AGRIN1GRIN2AMAPT

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 KDM5B 2786/4885MAT2A 1257/4885CXCR2 827/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR KDM5B 2786/4885MAT2A 1257/4885CXCR2 827/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR KDM5B 2786/4885MAT2A 1257/4885CXCR2 827/4885
US-20220009925-A1 CRYSTAL OF DIARYLTHIOHYDANTOIN COMPOUND SHBG, NR5A1, CYP21A2 KDM5B 2697/4885MAT2A 920/4885CXCR2 1864/4885

“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.