SCHEMBL2860384

SCHEMBL2860384

N#CCCNCCCCN

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.59
CA6 P23280 4/20 0.59
CA7 P43166 4/20 0.59
CA9 Q16790 4/20 0.59
CA14 Q9ULX7 4/20 0.59
CA5B Q9Y2D0 4/20 0.59
CA2 P00918 3/20 0.59
CA4 P22748 3/20 0.59
CA5A P35218 3/20 0.59
F13A1 P00488 2/20 0.59
CYP1A2 P05177 2/20 0.59
ALOX15 P16050 2/20 0.59
THPO P40225 2/20 0.59
CA3 P07451 2/20 0.59
CA1 P00915 1/20 0.59
CYP2C9 P11712 1/20 0.59
PKM P14618 1/20 0.59
TSHR P16473 1/20 0.59
MTOR P42345 1/20 0.59
LMNA P02545 1/20 0.56

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
Hydrochloric Acid SCHEMBL9347137 0.98 LMNA (0.61) CA12CA6CA7CA9CA14
SCHEMBL27669913 0.98 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL7526271 0.98 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL6326924 0.98 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL5153326 0.93
SCHEMBL2787125 0.91 CASP2 (0.62) CA12CA6CA7CA9CA14
SCHEMBL27605733 0.91 CA12 (0.59) CA12CA6CA7CA9CA14
SCHEMBL7775965 0.88 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL1260151 0.87
SCHEMBL1273487 0.87 ALDH1A1 (0.41) CA12CA6CA7CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212606-B1 SPERGUALIN-RELATED NITRILE COMPOUNDS CONTAINING A PHENYLENE GROUP AND A PROCESS FOR PRODUCING THE SAME MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1990-12-05 EP claimed
EP-0212606-A1 Spergualin-related nitrile compounds containing a phenylene group and a process for producing the same MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1987-03-04 EP claimed
JP-60178853-A None JP disclosed
JP-62048659-A None JP disclosed
CN-118580150-A Preparation process of spermidine 福州大学至诚学院 2024-09-03 CN disclosed
CN-115876904-A Method for detecting purity of spermidine hydrochloride and related substances thereof 尚科生物医药(上海)有限公司 2023-03-31 CN disclosed
CN-115876905-A Method for detecting purity of spermidine and related substances 尚科生物医药(上海)有限公司 2023-03-31 CN disclosed
US-8961927-B2 Agents for magnetic imaging method BRACCO IMAGING S.P.A. (IT) 2015-02-24 US disclosed
US-8961927-B2 Agents for magnetic imaging method BRACCO IMAGING S.P.A. (IT) 2015-02-24 US disclosed
US-20100311962-A1 Agents For Magnetic Imaging Method BRACCO IMAGING S.P.A. (IT) 2010-12-09 US disclosed
US-20100311962-A1 Agents For Magnetic Imaging Method BRACCO IMAGING S.P.A. (IT) 2010-12-09 US disclosed
EP-0212606-B1 SPERGUALIN-RELATED NITRILE COMPOUNDS CONTAINING A PHENYLENE GROUP AND A PROCESS FOR PRODUCING THE SAME MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1990-12-05 EP disclosed
EP-0394684-A1 Immunopotentiator and spergualin-related compound therefor NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1990-10-31 EP disclosed
EP-0353753-A1 Amide compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-02-07 EP disclosed
EP-0339927-A2 Amide compounds their production and use Takeda Chemical Industries, Ltd. (JP) 1989-11-02 EP disclosed
EP-0212606-A1 Spergualin-related nitrile compounds containing a phenylene group and a process for producing the same MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1987-03-04 EP disclosed
JP-S6248659-A SPERGUALIN-RELATING NITRILE COMPOUND HAVING PHENYLENE GROUP AND PRODUCTION THEREOF MICROBIAL CHEM RES FOUND 1987-03-03 JP disclosed
CN-85103298-A Process for preparing glyoxylylspermidine and its use for the preparation of 15-deoxyspergualin related compounds 1987-01-21 CN disclosed
US-4603015-A Method for producing glyoxylylspermidine and the use thereof for the production of 15-deoxy spergualin-related compounds TAKARA SHUZO COL., LTD. (JP) 1986-07-29 US disclosed
JP-S60178853-A SPERGUALIN-RELATING NITRILE COMPOUND AND ITS PREPARATION TAKARA SHUZO CO LTD 1985-09-12 JP 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 (1 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-20100311962-A1 Agents For Magnetic Imaging Method SLC19A1, SLC40A1, MPI CA12 167/4885CA6 554/4885CA7 465/4885

“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.