SCHEMBL29404209

SCHEMBL29404209

CN(C)C(=S)NN=C(c1ccccn1)c1ccccn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 3/20 0.55
TOP2A P11388 2/20 0.49
AGTR1 P30556 2/20 0.49
LMNA P02545 3/20 0.44
RAB9A P51151 3/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 2/20 0.44
MEN1 O00255 1/20 0.44
MITF O75030 1/20 0.44
TP53 P04637 1/20 0.44
APP P05067 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
SNCA P37840 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL1025308 1.00 HKDC1 (0.55) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL29506909 0.91 HKDC1 (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL881251 0.91 HKDC1 (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL5839502 0.86 TOP2A (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL29723632 0.86 TOP2A (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL29882877 0.86 TOP2A (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL17207742 0.86 TOP2A (0.67) HKDC1TOP2AAGTR1LMNARAB9A
SCHEMBL12562236 0.86 HKDC1 (0.46) HKDC1TOP2AAGTR1RAB9AKDM4E
SCHEMBL9938958 0.85 HKDC1 (0.54) HKDC1TOP2AAGTR1LMNARAB9A
Hydrochloric Acid SCHEMBL9938465 0.84 HKDC1 (0.53) HKDC1TOP2AAGTR1LMNARAB9A

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 90 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250381202-A1 PRODRUG KIT FOR MULTI-PRONGED CHEMOTHERAPY ZOUNEK ALEX (DE) 2025-12-18 US claimed
US-20250275946-A1 COMBINATION THERAPY FOR THE TREATMENT OF CANCER UNM RAINFOREST INNOVATIONS (US) 2025-09-04 US claimed
CN-120077031-A Prodrug kit for multitube concurrent chemotherapy 亚历克斯·祖内克 2025-05-30 CN claimed
EP-4551565-A1 PRODRUG KIT FOR MULTI-PRONGED CHEMOTHERAPY Zounek, Alex (DE) 2025-05-14 EP claimed
CN-118453558-A Use of iron chelators and their use in compositions with platinum compounds 广东医科大学附属医院 2024-08-09 CN claimed
WO-2024008833-A1 PRODRUG KIT FOR MULTI-PRONGED CHEMOTHERAPY ZOUNEK ALEX (DE) 2024-01-11 WO claimed
CN-116672457-A Application of pharmaceutical composition in preparation of candida albicans resistant medicines 上海市同济医院 2023-09-01 CN claimed
CN-116236481-A Application of Dp44mT in preparation of anti-candida albicans drugs 上海市同济医院 2023-06-09 CN claimed
WO-2023068423-A1 COMPLEX ANTICANCER DRUG COMPOSITION USING PHOTOREACTIVITY AND PREPARATION METHOD THEREFOR 닥터아이앤비(주) 2023-04-27 WO claimed
WO-2022169634-A9 COMBINATION THERAPY FOR THE TREATMENT OF CANCER UNM RAINFOREST INNOVATIONS (US) 2022-09-22 WO claimed
WO-2022169634-A1 COMBINATION THERAPY FOR THE TREATMENT OF CANCER UNM RAINFOREST INNOVATIONS (US) 2022-08-11 WO claimed
WO-2022037594-A1 USE OF IRON CHELATING AGENT IN PREPARATION OF DRUG FOR TREATING OR PREVENTING POLYOMAVIRUS INFECTION 上海市公共卫生临床中心 2022-02-24 WO claimed
CN-114073772-A Use of an iron chelator for the treatment or prevention of polyoma viral infections 上海市公共卫生临床中心 2022-02-22 CN claimed
WO-2026086847-A1 CYCLOPEPTIDE DRUG CONJUGATE AND USE THEREOF 中山医诺维申新药研发有限公司 2026-04-30 WO disclosed
CN-116672457-B Application of pharmaceutical composition in preparation of candida albicans resistant medicines 上海市同济医院 2026-04-07 CN disclosed
US-20260083865-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) LIGANDS AND USE THEREOF 3B PHARMACEUTICALS GMBH (DE) 2026-03-26 US disclosed
CN-114341158-A Compounds comprising fibroblast activation protein ligands and uses thereof 3B制药有限公司 2022-04-12 CN disclosed
WO-2022063351-A1 AZULENE HYDRAZIDE-HYDRAZONES AND THEIR USE IN THE TREATMENT OF ONCOLOGIC DISEASES UNIVERZITA KARLOVA (CZ) 2022-03-31 WO disclosed
WO-2022037594-A1 USE OF IRON CHELATING AGENT IN PREPARATION OF DRUG FOR TREATING OR PREVENTING POLYOMAVIRUS INFECTION 上海市公共卫生临床中心 2022-02-24 WO disclosed
CN-114073772-A Use of an iron chelator for the treatment or prevention of polyoma viral infections 上海市公共卫生临床中心 2022-02-22 CN 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 (2 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-20250381202-A1 PRODRUG KIT FOR MULTI-PRONGED CHEMOTHERAPY KIT, CTSL, PAICS HKDC1 1037/4885TOP2A 299/4885AGTR1 3420/4885
US-20260083865-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) LIGANDS AND USE THEREOF KLK3, FOLH1, PSMA1 HKDC1 580/4885TOP2A 827/4885AGTR1 279/4885

“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.