SCHEMBL11052220

SCHEMBL11052220

NC(=O)NS(=O)(=O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 6/20 0.40
▸ MMP1 P03956 1/20 0.37
▸ MMP7 P09237 1/20 0.37
▸ MMP12 P39900 1/20 0.37
▸ ECE1 P42892 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 1/20 0.35
▸ EPHX2 P34913 2/20 0.35
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MALT1 Q9UDY8 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP3A4 P08684 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
SCHEMBL27704919 0.89 TDP1 (0.34) EPHX1CA2CYP3A4SCN9ASCN5A
SCHEMBL22169643 0.78 MMP1 (0.41) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL19631002 0.78 MMP1 (0.41) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL22169723 0.78 MMP1 (0.41) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL22169644 0.78 MMP1 (0.41) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL22169725 0.77 HDAC8 (0.50) EPHX1CA1CA2EPHX2MAPT
SCHEMBL22169636 0.77 HDAC8 (0.45) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL19630978 0.76 MMP1 (0.38) MMP1MMP7MMP12ECE1MMP13
SCHEMBL19629757 0.75 MMP1 (0.39) EPHX1MMP1MMP7MMP12ECE1
SCHEMBL22169769 0.75 HDAC8 (0.48) EPHX1CA1CA2EPHX2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4439370-A Preparation of trans cyclohexane 1,4-diisocyanate AKZONA INCORPORATED (US) 1984-03-27 — — US claimed
CN-118986931-A Staphylococcus aureus membrane-encapsulated endoplasmic reticulum targeting nanoparticle and application thereof 中国人民解放军陆军军医大学第二附属医院 2024-11-22 — — CN disclosed
CN-112472822-B Construction and application of endoplasmic reticulum targeted nano drug delivery system 浙江大学 2022-05-27 — — CN disclosed
CN-112472822-A Construction and application of endoplasmic reticulum targeted nano drug delivery system 浙江大学 2021-03-12 — — CN disclosed
US-4486603-A Preparation of trans cyclohexane 1,4-diamine AKZONA INCORPORATED (US) 1984-12-04 — — US disclosed
US-4486603-A Preparation of trans cyclohexane 1,4-diamine AKZONA INCORPORATED (US) 1984-12-04 — — US disclosed
US-4467114-A Preparation of trans cyclohexane 1,4-diurea AKZONA INCORPORATED (US) 1984-08-21 — — US disclosed
US-4467114-A Preparation of trans cyclohexane 1,4-diurea AKZONA INCORPORATED (US) 1984-08-21 — — US disclosed
US-4457871-A Preparation of trans cyclohexane,1,4-diisocyanate and related compounds AKZONA INCORPORATED (US) 1984-07-03 — — US disclosed
US-4457871-A Preparation of trans cyclohexane,1,4-diisocyanate and related compounds AKZONA INCORPORATED (US) 1984-07-03 — — US disclosed
US-4439370-A Preparation of trans cyclohexane 1,4-diisocyanate AKZONA INCORPORATED (US) 1984-03-27 — — US disclosed
US-4439370-A Preparation of trans cyclohexane 1,4-diisocyanate AKZONA INCORPORATED (US) 1984-03-27 — — US disclosed
US-4418211-A Preparation of trans-cyclohexane-1,4-disulphonyl urea AKZONA INCORPORATED (US) 1983-11-29 — — US disclosed
US-4418211-A Preparation of trans-cyclohexane-1,4-disulphonyl urea AKZONA INCORPORATED (US) 1983-11-29 — — US disclosed
US-4275223-A Preparation of trans-cyclohexane-1,4-diurethanes AKZONA INCORPORATED (US) 1981-06-23 — — US disclosed
US-4275223-A Preparation of trans-cyclohexane-1,4-diurethanes AKZONA INCORPORATED (US) 1981-06-23 — — US disclosed
US-4203916-A Preparation of trans cyclohexane 1,4 diisocyanate AKZONA INCORPORATED (US) 1980-05-20 — — US disclosed
US-4203916-A Preparation of trans cyclohexane 1,4 diisocyanate AKZONA INCORPORATED (US) 1980-05-20 — — US disclosed
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