SCHEMBL15967828

SCHEMBL15967828

CC(=O)OCCCCOC(C)=O.[CaH2]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.70
TSHR P16473 4/20 0.52
CHRM5 P08912 2/20 0.52
CHRM1 P11229 2/20 0.52
CHRM3 P20309 2/20 0.52
PGR P06401 1/20 0.52
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52
HTR1A P08908 1/20 0.52
CHRNB2 P17787 1/20 0.52
TBXA2R P21731 1/20 0.52
CHRNB4 P30926 1/20 0.52
CHRNA3 P32297 1/20 0.52
CHRNA7 P36544 1/20 0.52
CHRNA4 P43681 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CHRNA10 Q9GZZ6 1/20 0.52
CHRNA9 Q9UGM1 1/20 0.52
LMNA P02545 2/20 0.50
GALR3 O60755 2/20 0.50

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
SCHEMBL189930 0.97 ALDH1A1 (0.74) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL273326 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL11491818 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL29414114 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL4441760 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL5136503 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL8607908 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15299079 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL11492305 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL250642 0.94 ALDH1A1 (0.70) ALDH1A1TSHRCHRM5CHRM1CHRM3

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220168336-A1 NITRIC OXIDE RELEASING SUPPOSITORIES AND METHODS OF USE THEREOF LNHC, INC. 2022-06-02 US claimed
EP-3758679-A1 NITRIC OXIDE RELEASING SUPPOSITORIES AND METHODS OF USE THEREOF Novan, Inc. (US) 2021-01-06 EP claimed
US-20200397815-A1 NITRIC OXIDE RELEASING SUPPOSITORIES AND METHODS OF USE THEREOF LIGAND PHARMACEUTICALS INCORPORATED 2020-12-24 US claimed
WO-2024074894-A1 POLYMERIC MICELLE NANOCARRIERS FOR TARGETED EPIDERMAL DELIVERY OF THE HEDGEHOG PATHWAY INHIBITOR TAK-441 UNIVERSITÉ DE GENÈVE (CH) 2024-04-11 WO disclosed
US-11813284-B2 Topical compositions and methods of using the same NOVAN, INC. (US) 2023-11-14 US disclosed
US-20230330008-A1 TOPICAL ANTIVIRAL COMPOSITIONS, DELIVERY SYSTEMS, AND METHODS OF USING THE SAME LIGAND PHARMACEUTICALS INCORPORATED 2023-10-19 US disclosed
EP-3579888-B1 ELECTROCHEMICAL GASOTRANSMITTER GENERATING COMPOSITIONS AND METHODS OF USING SAME AND DRESSINGS AND TREATMENT SYSTEMS INCORPORATING SAME NOXSANO INC (US) 2023-09-27 EP disclosed
US-11723858-B2 Topical antiviral compositions, delivery systems, and methods of using the same NOVAN, INC. (US) 2023-08-15 US disclosed
US-20230144853-A1 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME LNHC, INC. 2023-05-11 US disclosed
US-11534382-B2 Topical compositions and methods of using the same NOVAN, INC. (US) 2022-12-27 US disclosed
US-11369682-B2 Light activated gasotransmitter generating compositions Noxsano Inc. (US) 2022-06-28 US disclosed
US-20160199295-A1 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME LIGAND PHARMACEUTICALS INCORPORATED 2016-07-14 US disclosed
EP-3030266-A2 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME Novan Inc. (US) 2016-06-15 EP disclosed
WO-2016022170-A1 TOPICAL EMULSIONS NOVAN, INC. (US) 2016-02-11 WO disclosed
US-20160008275-A1 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME LIGAND PHARMACEUTICALS INCORPORATED 2016-01-14 US disclosed
WO-2016007834-A1 TOPICAL ANTIVIRAL COMPOSITIONS AND METHODS OF USING THE SAME NOVAN, INC. (US) 2016-01-14 WO disclosed
EP-2961382-A1 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME Novan Inc. (US) 2016-01-06 EP disclosed
WO-2015021382-A2 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME NOVAN, INC. (US) 2015-02-12 WO disclosed
WO-2014134502-A1 TOPICAL COMPOSITIONS AND METHODS OF USING THE SAME NOVAN, INC. (US) 2014-09-04 WO disclosed
US-20140242023-A1 Topical Compositions and Methods of Using the Same NOVAN, INC. (US) 2014-08-28 US disclosed