SCHEMBL21143482

SCHEMBL21143482

CCCCCCCCNc1cc(Cl)ccc1C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 6/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ EPHX1 P07099 3/20 0.46
▸ POLB P06746 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PNLIP P16233 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
SCHEMBL11311346 0.81 ALDH1A1 (0.43) KDM4EALDH1A1POLBTHRBRECQL
SCHEMBL14139915 0.78 HRH3 (0.52) —
SCHEMBL6532561 0.77 CNR2 (0.56) KDM4EALDH1A1L3MBTL1
SCHEMBL9194517 0.76 ABL1 (0.47) CISD1KDM4E
SCHEMBL15635741 0.76 KDM4E (0.63) CISD1KDM4EALDH1A1POLBTHRB
SCHEMBL7549269 0.76 ABL1 (0.44) CISD1KDM4EALDH1A1EPHX1
SCHEMBL12513577 0.76 CXCR4 (0.46) KDM4EALDH1A1
SCHEMBL28655003 0.75 KDM4E (0.53) CISD1KDM4EALDH1A1POLB
SCHEMBL12513692 0.75 LMNA (0.55) ALDH1A1L3MBTL1
SCHEMBL12513580 0.74 GAA (0.52) KDM4EALDH1A1

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
CN-109195599-B Antifungal composition 株式会社种探索研究所 2023-02-03 — — CN disclosed
EP-3960172-A1 ANTIFUNGAL COMPOSITION Seed Research Institute Co., Ltd. (JP) 2022-03-02 — — EP disclosed
US-10980813-B2 Antifungal composition SEED RESEARCH INSTITUTE CO., LTD. (JP) 2021-04-20 — — US disclosed
US-20190216820-A1 ANTIFUNGAL COMPOSITION SEED RESEARCH INSTITUTE CO., LTD. (JP) 2019-07-18 — — 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 (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-20190216820-A1 ANTIFUNGAL COMPOSITION ERG28, NR2E1, NR2C2 CISD1 2044/4885KDM4E 3754/4885ALDH1A1 4071/4885
US-10980813-B2 Antifungal composition ERG28, NR2E1, NR2C2 CISD1 2044/4885KDM4E 3754/4885ALDH1A1 4071/4885

“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.

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