SCHEMBL13567271

SCHEMBL13567271

COC(=O)CCCCCNCCO

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
LMNA P02545 3/20 0.48
ALDH1A1 P00352 2/20 0.48
PAOX Q6QHF9 3/20 0.46
EPHX2 P34913 4/20 0.45
HSD17B10 Q99714 1/20 0.42
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CNR2 P34972 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL18641686 1.00 TSHR (0.54) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL23132220 1.00 TSHR (0.54) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL20283628 0.92 TSHR (0.64) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL8214934 0.92 TSHR (0.64) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL2586098 0.92 TSHR (0.64) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL16730520 0.92 TSHR (0.64) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL18970748 0.90 TP53 (0.45) TSHRLMNAALDH1A1EPHX2HSD17B10
Hydrochloric Acid SCHEMBL2579652 0.90 TSHR (0.61) TSHRLMNAALDH1A1PAOXEPHX2
Hydrochloric Acid SCHEMBL2583424 0.90 TSHR (0.61) TSHRLMNAALDH1A1PAOXEPHX2
SCHEMBL13903715 0.84 CA12 (0.59) TSHRLMNAALDH1A1EPHX2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023133946-A1 CATIONIC LIPID COMPOUND, COMPOSITION CONTAINING SAME AND USE THEREOF 杭州天龙药业有限公司 2023-07-20 WO disclosed
WO-2023098842-A1 NUCLEIC ACID VACCINES FOR CORONAVIRUS BASED ON SEQUENCES DERIVED FROM SARS-CoV-2 OMICRON STRAIN Suzhou Abogen Biosciences Co., Ltd. (CN) 2023-06-08 WO disclosed
WO-2023056911-A1 MULTIVALENT NUCLEIC ACID VACCINES FOR CORONAVIRUS BASED ON SEQUENCES DERIVED FROM SARS-CoV-2 BETA AND DELTA STRAINS Suzhou Abogen Biosciences Co., Ltd. (CN) 2023-04-13 WO disclosed
US-11472766-B2 Lipid nanoparticle composition Suzhou Abogen Biosciences Co., Ltd. (CN) 2022-10-18 US disclosed
US-20220153686-A1 LIPID NANOPARTICLE COMPOSITION Suzhou Abogen Biosciences Co., Ltd. (CN) 2022-05-19 US disclosed
US-9791450-B2 Fluorescent compounds BIOTIUM, INC. (US) 2017-10-17 US disclosed
US-9791450-B2 Fluorescent compounds BIOTIUM, INC. (US) 2017-10-17 US disclosed
EP-2223086-B2 FLUORESCENT COMPOUNDS - LABELING DYES BIOTIUM INC (US) 2016-06-01 EP disclosed
US-20160033520-A1 FLUORESCENT COMPOUNDS BIOTIUM, INC. 2016-02-04 US disclosed
US-20160033520-A1 FLUORESCENT COMPOUNDS BIOTIUM, INC. 2016-02-04 US disclosed
US-9097667-B2 Fluorescent compounds BIOTIUM, INC. (US) 2015-08-04 US disclosed
US-20090305410-A1 FLUORESCENT COMPOUNDS BIOTIUM, INC. (US) 2009-12-10 US 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 (3 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-20220153686-A1 LIPID NANOPARTICLE COMPOSITION CETP, NPC1, LCAT TSHR 4385/4885LMNA 218/4885ALDH1A1 4587/4885
US-20090305410-A1 FLUORESCENT COMPOUNDS MKI67, CD68, CA5B TSHR 4234/4885LMNA 539/4885ALDH1A1 62/4885
US-11472766-B2 Lipid nanoparticle composition CETP, NPC1, LCAT TSHR 4385/4885LMNA 218/4885ALDH1A1 4587/4885

“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.