SCHEMBL31175320

SCHEMBL31175320

S=C=NC1CNCCNCCNCCN1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.45
▸ CYP2C19 P33261 2/20 0.40
▸ SLC6A4 P31645 5/20 0.38
▸ SLC6A2 P23975 4/20 0.38
▸ SLC6A3 Q01959 2/20 0.38
▸ NAAA Q02083 1/20 0.38
▸ GBA1 P04062 1/20 0.37
▸ CXCR4 P61073 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ MITF O75030 1/20 0.35
▸ HTR3A P46098 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CHRM2 P08172 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ ADRA2C P18825 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
SCHEMBL9539892 0.74 SLC6A2 (0.42) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL27705364 0.72 SIGMAR1 (0.53) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL8101234 0.72 SIGMAR1 (0.53) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL1738860 0.72 SIGMAR1 (0.53) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL2080509 0.72 SIGMAR1 (0.53) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL104186 0.71 SIGMAR1 (0.51) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL104187 0.71 SIGMAR1 (0.51) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL1934350 0.71 SIGMAR1 (0.51) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL104699 0.71 SIGMAR1 (0.51) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3
SCHEMBL27814773 0.71 SIGMAR1 (0.56) SIGMAR1CYP2C19SLC6A4SLC6A2SLC6A3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250339570-A1 RADIOIMMUNOCONJUGATES AND THERAPEUTIC USES THEREOF UNIV CALIFORNIA (US) 2025-11-06 — — US disclosed
US-20250127943-A1 METHODS AND COMPOSITIONS FOR TARGETING DISEASE RELATED CELL SURFACE RECEPTORS USING RADIOLABELED AND/OR CYTOTOXIN LABELLED ANTIBODIES UNIVERSITY OF SASKATCHEWAN (CA) 2025-04-24 — — US disclosed
US-12151004-B2 Methods and compositions for targeting disease related cell surface receptors using radiolabeled and/or cytotoxin labelled antibodies UNIVERSITY OF SASKATCHEWAN (CA) 2024-11-26 — — 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 (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-12151004-B2 Methods and compositions for targeting disease related cell surface receptors using radiolabeled and/or cytotoxin labelled antibodies CD47, HAVCR2, ASGR1 SIGMAR1 288/4885CYP2C19 4626/4885SLC6A4 4110/4885
US-20250127943-A1 METHODS AND COMPOSITIONS FOR TARGETING DISEASE RELATED CELL SURFACE RECEPTORS USING RADIOLABELED AND/OR CYTOTOXIN LABELLED ANTIBODIES CD47, HAVCR2, ASGR1 SIGMAR1 288/4885CYP2C19 4626/4885SLC6A4 4110/4885
US-20250339570-A1 RADIOIMMUNOCONJUGATES AND THERAPEUTIC USES THEREOF ITGA6, CD4, ITGB6 SIGMAR1 1772/4885CYP2C19 4627/4885SLC6A4 3089/4885

“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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