SCHEMBL3101607

SCHEMBL3101607

CCCCN(CCCC)C(CC)CO

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP8 P22894 1/20 0.34
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA9 Q16790 3/20 0.32
ALDH2 P05091 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
CA2 P00918 1/20 0.30

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
SCHEMBL26129752 0.91 LMNA (0.41) ALDH1A1LMNACA12CA1CA9
SCHEMBL29059636 0.91 LMNA (0.41) ALDH1A1LMNACA12CA1CA9
SCHEMBL11864376 0.91 LMNA (0.41) ALDH1A1LMNACA12CA1CA9
SCHEMBL31099214 0.86 LMNA (0.39) ALDH1A1LMNACA12CA1CA9
SCHEMBL3106202 0.85 FDPS (0.39) ALDH1A1LMNATSHR
SCHEMBL11195464 0.85 MMP1 (0.34) ALDH1A1LMNAMMP1MMP2MMP3
SCHEMBL11193257 0.84 LMNA (0.38) ALDH1A1LMNAMMP1MMP2MMP3
SCHEMBL11866792 0.80 LMNA (0.50) ALDH1A1LMNACA12CA1CA9
SCHEMBL5181936 0.80 MAPT (0.35)
SCHEMBL1041215 0.79 ALDH1A1 (0.39) ALDH1A1LMNAMMP1MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116249448-B Antibacterial composition 株式会社LG化学 2026-02-27 CN disclosed
US-20250129009-A1 Compound and Method for Identifying Impurities Included Therein LG CHEM, LTD. (KR) 2025-04-24 US disclosed
US-20250122144-A1 Compound and Molded Body Comprising Same LG CHEM, LTD. (KR) 2025-04-17 US disclosed
CN-118749003-A Copolymer, antibacterial deodorant composition containing same, and method for producing same 株式会社LG化学 2024-10-08 CN disclosed
CN-118510749-A Compounds and methods for determining impurities contained therein 株式会社LG化学 2024-08-16 CN disclosed
CN-118510748-A Compound and molded body comprising the same 株式会社LG化学 2024-08-16 CN disclosed
CN-118475623-A Antibacterial resin and molded body containing same 株式会社LG化学 2024-08-09 CN disclosed
CN-118451115-A Antibacterial resin, composition for preparing the same, and molded body comprising the same 株式会社LG化学 2024-08-06 CN disclosed
CN-116828983-A antibacterial composition 株式会社LG化学 2023-09-29 CN disclosed
CN-116249448-A Antibacterial composition 株式会社LG化学 2023-06-09 CN disclosed
EP-2204394-B1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS TOSOH CORP (JP) 2017-07-12 EP disclosed
US-8980965-B2 Method for producing polyester type flexible polyurethane foam, and catalyst composition to be used therefor TOSOH CORPORATION (JP) 2015-03-17 US disclosed
US-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR TOSOH CORPORATION (JP) 2010-10-07 US disclosed
EP-2204394-A1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS Tosoh Corporation (JP) 2010-07-07 EP 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-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR OR51E2, CYP4F11, FFAR3 ALDH1A1 2369/4885LMNA 3374/4885MMP1 2820/4885
US-20250129009-A1 Compound and Method for Identifying Impurities Included Therein MMAB, TET2, AS3MT ALDH1A1 1551/4885LMNA 92/4885MMP1 4615/4885
US-20250122144-A1 Compound and Molded Body Comprising Same ERG28, CYP2E1, CYP51A1 ALDH1A1 105/4885LMNA 3669/4885MMP1 2327/4885

“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.