SCHEMBL6887590

SCHEMBL6887590

c1cc(N2CCCCC2)ccc1N1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.71
▸ MAPT P10636 5/20 0.71
▸ L3MBTL1 Q9Y468 5/20 0.71
▸ ALOX15 P16050 4/20 0.71
▸ NPC1 O15118 3/20 0.71
▸ RAB9A P51151 3/20 0.71
▸ KDM4E B2RXH2 2/20 0.71
▸ MEN1 O00255 2/20 0.71
▸ GAA P10253 2/20 0.71
▸ HTT P42858 2/20 0.71
▸ KMT2A Q03164 2/20 0.71
▸ TP53 P04637 2/20 0.71
▸ HSD17B10 Q99714 2/20 0.71
▸ USP2 O75604 1/20 0.71
▸ POLB P06746 1/20 0.71
▸ THRB P10828 1/20 0.71
▸ RECQL P46063 1/20 0.71
▸ NPSR1 Q6W5P4 1/20 0.71
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ TDP1 Q9NUW8 3/20 0.62

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
SCHEMBL2174173 0.97 ALDH1A1 (0.67) ALDH1A1MAPTL3MBTL1ALOX15NPC1
Hydrochloric Acid SCHEMBL29475563 0.93 ALDH1A1 (0.71) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL31013493 0.91 ALDH1A1 (0.62) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL28356161 0.90 ALDH1A1 (0.59) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL11548897 0.88 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL2703274 0.87 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL82441 0.87 ADRB1 (0.61) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL539280 0.87 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL20748279 0.87 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15NPC1
SCHEMBL20908718 0.87 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552223-B1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS NOVO NORDISK AS (DK) 1996-07-17 — — EP claimed
EP-0552223-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS. NOVO NORDISK AS (DK) 1993-07-28 — — EP claimed
US-5155048-A Organic reagent for the colorimetric detection of chlorine and ozone in drinking water CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-10-13 — — US claimed
WO-1992007263-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS NOVO NORDISK A/S (DK) 1992-04-30 — — WO claimed
CN-113646899-B n-type semiconductor element, method for manufacturing n-type semiconductor element, wireless communication device, and commodity tag 东丽株式会社 2024-03-12 — — CN disclosed
US-20040161367-A1 Apparatus and method for detecting chlorine dioxide NEXTTEQ, LLC 2004-08-19 — — US disclosed
EP-0552223-B1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS NOVO NORDISK AS (DK) 1996-07-17 — — EP disclosed
EP-0552223-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS. NOVO NORDISK AS (DK) 1993-07-28 — — EP disclosed
US-5155048-A Organic reagent for the colorimetric detection of chlorine and ozone in drinking water CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-10-13 — — US disclosed
US-5155048-A Organic reagent for the colorimetric detection of chlorine and ozone in drinking water CENTER FOR INNOVATIVE TECHNOLOGY (US) 1992-10-13 — — US disclosed
WO-1992007263-A1 USE OF BENZENE DERIVATIVES AS CHARGE TRANSFER MEDIATORS NOVO NORDISK A/S (DK) 1992-04-30 — — WO disclosed
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