SCHEMBL22101466

SCHEMBL22101466

O=c1[nH]c(Cl)nc2c(F)cc(Br)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.37
TNKS O95271 4/20 0.37
TNKS2 Q9H2K2 4/20 0.37
PARP2 Q9UGN5 2/20 0.37
PARP3 Q9Y6F1 1/20 0.37
PIM1 P11309 4/20 0.37
CSNK2A2 P19784 4/20 0.37
CSNK2B P67870 4/20 0.37
PIM3 Q86V86 4/20 0.37
PIM2 Q9P1W9 4/20 0.37
PARP4 Q9UKK3 2/20 0.36
PTGES O14684 4/20 0.34
MAPT P10636 2/20 0.34
EGLN1 Q9GZT9 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 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
SCHEMBL29142195 0.83 PARP1 (0.36) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL22028973 0.78 PARP1 (0.36) PARP1PIM1CSNK2A2CSNK2BPIM3
SCHEMBL22393820 0.78 PKM (0.46) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL22101792 0.78 PIM1 (0.38) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL30826848 0.78 PARP1 (0.36) PARP1PIM1CSNK2A2CSNK2BPIM3
SCHEMBL22101365 0.76 PARP1 (0.47) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL22393695 0.76 PARP2 (0.38) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL22101861 0.75 PARP1 (0.42) PARP1TNKSTNKS2PARP2PARP3
SCHEMBL22101758 0.75 CDC7 (0.47) PARP1TNKSTNKS2PIM1CSNK2B
SCHEMBL577862 0.75 PARP1 (0.51) PARP1TNKSTNKS2PARP2PIM1

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 PARP1 3854/4885TNKS 2033/4885TNKS2 1465/4885
US-20200277290-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST AR, NR5A1, LHCGR PARP1 3854/4885TNKS 2033/4885TNKS2 1465/4885
US-11332465-B2 Diarylthiohydantoin compound as androgen receptor antagonist AR, NR5A1, LHCGR PARP1 3854/4885TNKS 2033/4885TNKS2 1465/4885

“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.