SCHEMBL22101413

SCHEMBL22101413

CCc1cc(=O)n2cc(NC(=O)OC(C)(C)C)cc(F)c2n1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 2/20 0.37
BRD4 O60885 2/20 0.36
P2RX3 P56373 1/20 0.36
ACKR3 P25106 2/20 0.35
MAPK14 Q16539 1/20 0.35
ACSS2 Q9NR19 1/20 0.35
SYK P43405 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
SREBF2 Q12772 1/20 0.34
CYP17A1 P05093 1/20 0.34
BRD9 Q9H8M2 1/20 0.34
EGLN2 Q96KS0 2/20 0.33
TOP2A P11388 1/20 0.33
TOP2B Q02880 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL22101442 0.84 P2RX3 (0.37) MAPKAPK2BRD4P2RX3MAPK14ACSS2
SCHEMBL22101455 0.83 P2RX3 (0.36) BRD4P2RX3SYKCA12CA1
SCHEMBL22101361 0.80 KDM4E (0.34) ACKR3SYKLMNATP53
SCHEMBL22101360 0.80 MAPT (0.35) ACKR3LMNATP53
SCHEMBL22101447 0.76 BCAT2 (0.33)
SCHEMBL22393704 0.74 MAPT (0.36) LMNATP53
SCHEMBL22101400 0.72 CXCR2 (0.38) ACKR3TP53
SCHEMBL22101725 0.72 GRIN1 (0.40) ACKR3
SCHEMBL22393919 0.71 KDM5B (0.36)
SCHEMBL22101411 0.71 KDM5B (0.36) TP53

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 MAPKAPK2 1185/4885BRD4 1171/4885P2RX3 2446/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR MAPKAPK2 1185/4885BRD4 1171/4885P2RX3 2446/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR MAPKAPK2 1185/4885BRD4 1171/4885P2RX3 2446/4885
US-20220009925-A1 CRYSTAL OF DIARYLTHIOHYDANTOIN COMPOUND SHBG, NR5A1, CYP21A2 MAPKAPK2 2916/4885BRD4 3498/4885P2RX3 2342/4885

“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.