SCHEMBL6608042

SCHEMBL6608042

Nc1ccc(N2CCCCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.95
MAPT P10636 9/20 0.95
GAA P10253 4/20 0.95
KDM4E B2RXH2 4/20 0.95
L3MBTL1 Q9Y468 4/20 0.95
HTT P42858 3/20 0.95
KMT2A Q03164 3/20 0.95
ALOX15 P16050 3/20 0.95
MEN1 O00255 2/20 0.95
POLB P06746 2/20 0.95
NPC1 O15118 1/20 0.95
USP2 O75604 1/20 0.95
TP53 P04637 1/20 0.95
THRB P10828 1/20 0.95
RECQL P46063 1/20 0.95
RAB9A P51151 1/20 0.95
NPSR1 Q6W5P4 1/20 0.95
HSD17B10 Q99714 1/20 0.95
LMNA P02545 5/20 0.61
GFER P55789 4/20 0.61

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
SCHEMBL1986101 1.00 ALDH1A1 (0.95) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL156355 1.00 ALDH1A1 (0.95) ALDH1A1MAPTGAAKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL9014036 0.98 ALDH1A1 (1.00) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL33852 0.97 ALDH1A1 (0.91) ALDH1A1MAPTGAAKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL1153999 0.95 ALDH1A1 (0.95) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL7130594 0.93 ALDH1A1 (0.83) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL1858354 0.92 ALDH1A1 (0.82) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL7128309 0.91 ALDH1A1 (0.79) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL112440 0.90 MAPT (0.78) ALDH1A1MAPTGAAKDM4EL3MBTL1
Hydrochloric Acid SCHEMBL5169602 0.88 MAPT (0.83) ALDH1A1MAPTGAAKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115151252-B Iron death inhibitor-diarylamine acetamides 维泰瑞隆有限公司 2024-08-27 CN disclosed
US-20230159492-A1 FERROPTOSIS INHIBITORS - DIARYLAMINE PARA-ACETAMIDES Sironax Ltd. (KY) 2023-05-25 US disclosed
US-20040198731-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040198732-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040198733-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-07 US disclosed
US-20040192693-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-09-30 US disclosed
EP-1418906-A1 AMINOALKYL-SUBSTITUTED AROMATIC BICYCLIC COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2004-05-19 EP disclosed
US-20030212070-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-11-13 US disclosed
WO-2003015769-A1 AMINOALKYL-SUBSTITUTED AROMATIC BICYCLIC COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-02-27 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 (6 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-20030212070-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC ALDH1A1 404/4885MAPT 3514/4885GAA 1687/4885
US-20040192693-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC ALDH1A1 404/4885MAPT 3514/4885GAA 1687/4885
US-20040198731-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC ALDH1A1 404/4885MAPT 3514/4885GAA 1687/4885
US-20040198733-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC ALDH1A1 404/4885MAPT 3514/4885GAA 1687/4885
US-20040198732-A1 Aminoalkyl-substituted aromatic bicyclic compounds, methods for their preparation and their use as pharmaceuticals PER2, CNR2, DDC ALDH1A1 404/4885MAPT 3514/4885GAA 1687/4885
US-20230159492-A1 FERROPTOSIS INHIBITORS - DIARYLAMINE PARA-ACETAMIDES AIFM2, FECH, GPX4 ALDH1A1 395/4885MAPT 4384/4885GAA 4193/4885

“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.