SCHEMBL21683001

SCHEMBL21683001

O=C(Nc1ccc(N2CCN(c3ccccn3)CC2)cc1C(=O)O)c1ccco1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ HSD17B10 Q99714 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ GAA P10253 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ ALOX15 P16050 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ MAPK1 P28482 3/20 0.48
▸ CYP3A4 P08684 3/20 0.48
▸ CYP2D6 P10635 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ CYP1A2 P05177 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46

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
SCHEMBL21701587 0.97 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21701591 0.89 SMN1; SMN2 (0.55) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21701579 0.86 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21701474 0.81 SMN1; SMN2 (0.58) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21683033 0.80 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21701581 0.79 POLB (0.56) ALDH1A1SMN1; SMN2HSD17B10KDM4EKMT2A
SCHEMBL21701594 0.77 F10 (0.57) ALDH1A1SMN1; SMN2GAAKMT2ACYP3A4
SCHEMBL21683032 0.72 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL15528812 0.70 MAPK1 (0.71) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA
SCHEMBL21701478 0.70 CYP1A2 (0.61) ALDH1A1SMN1; SMN2HSD17B10KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12365659-B2 Non-polyamine based polyamine transport inhibitors and their use in the treatment of human cancers UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2025-07-22 — — US disclosed
US-20240166614-A1 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2024-05-23 — — US disclosed
US-11905268-B2 Anthranilic acid derivatives and their use in the treatment of human cancers UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-02-20 — — US disclosed
US-20220064133-A1 ANTHRANILIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS Sanford Burnham Prebys Medical Discovery Institute 2022-03-03 — — US disclosed
EP-3833352-A2 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS University of Central Florida Research Foundation, Inc. (US) 2021-06-16 — — EP disclosed
WO-2020033944-A2 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2020-02-13 — — WO disclosed
WO-2020033944-A2 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2020-02-13 — — WO 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 (4 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-11905268-B2 Anthranilic acid derivatives and their use in the treatment of human cancers ANXA6, ANXA1, ANTXR2 ALDH1A1 163/4885SMN1; SMN2 589/4885HSD17B10 2667/4885
US-20220064133-A1 ANTHRANILIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS ENY2, ANTXR2, ALAD ALDH1A1 1777/4885SMN1; SMN2 2909/4885HSD17B10 2329/4885
US-12365659-B2 Non-polyamine based polyamine transport inhibitors and their use in the treatment of human cancers SLC19A1, PNMT, SRM ALDH1A1 538/4885SMN1; SMN2 785/4885HSD17B10 4175/4885
US-20240166614-A1 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS SLC19A1, PNMT, SRM ALDH1A1 538/4885SMN1; SMN2 785/4885HSD17B10 4175/4885

“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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