SCHEMBL3412253

SCHEMBL3412253

CCC(C)CCC(=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 0.31
GABRQ Q9UN88 2/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 2/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL27737606 1.00 CA1 (0.32) CA1GABRPGABRDGABRA1GABRB1
SCHEMBL27674568 1.00 CA1 (0.32) CA1GABRPGABRDGABRA1GABRB1
SCHEMBL29236950 0.91 CYP1A2 (0.35) CYP1A2
SCHEMBL20999895 0.87 CA1 (0.36) CA1GABRPGABRDGABRA1GABRB1
SCHEMBL18803111 0.83 TSHR (0.44) CA1TSHRMAPT
SCHEMBL11892063 0.82 ACE2 (0.41) TSHR
SCHEMBL12525346 0.82 ACE2 (0.41) TSHR
SCHEMBL10489488 0.81 CA1 (0.30) CA1
SCHEMBL10489490 0.81 CA1 (0.30) CA1
SCHEMBL1509700 0.79 CA1 (0.35) CA1GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132000-B2 Agents for oxidatively dying keratin fibers WELLA AG (DE) 2006-11-07 US claimed
US-12552129-B2 Nonwoven water-soluble composite structure MONOSOL, LLC (US) 2026-02-17 US disclosed
EP-4382083-B1 NONWOVEN WATER-SOLUBLE COMPOSITE STRUCTURE MONOSOL LLC (US) 2025-06-25 EP disclosed
CN-114829143-B Water-soluble nonwoven composite structure 蒙诺苏尔有限公司 2025-06-17 CN disclosed
CN-119116495-A Water-soluble nonwoven composite structure 蒙诺苏尔有限公司 2024-12-13 CN disclosed
US-20240401246-A1 WATER SOLUBLE FIBERS WITH POST PROCESS MODIFICATIONS AND ARTICLES CONTAINING SAME MONOSOL, LLC 2024-12-05 US disclosed
EP-4442872-A2 WATER SOLUBLE FIBERS WITH POST PROCESS MODIFICATIONS AND ARTICLES CONTAINING SAME Monosol, LLC (US) 2024-10-09 EP disclosed
US-12060658-B2 Water soluble fibers with post process modifications and articles containing same MONOSOL, LLC (US) 2024-08-13 US disclosed
EP-4382083-A2 NONWOVEN WATER-SOLUBLE COMPOSITE STRUCTURE Monosol, LLC (US) 2024-06-12 EP disclosed
EP-4375401-A2 WATER SOLUBLE FIBERS WITH POST PROCESS MODIFICATIONS AND ARTICLES CONTAINING SAME Monosol, LLC (US) 2024-05-29 EP disclosed
CN-101001832-A Use of dynamic mixtures for controlled fragrance release FIRMENICH & CIE (CH) 2007-07-18 CN disclosed
CN-1252023-C Insect repellent FULLTEC AG (CH) 2006-04-19 CN disclosed
US-20040265349-A1 Insect repellent FULLTEC AG (CH) 2004-12-30 US disclosed
CN-1549804-A Insect repellent 2004-11-24 CN disclosed
EP-1412314-A1 INSECT REPELLENT FULLTEC AG (CH) 2004-04-28 EP disclosed
EP-1305272-A2 PHENOLIC COMPOUNDS AND POLYMERS DERIVED THEREFROM GENERAL ELECTRIC COMPANY (US) 2003-05-02 EP disclosed
WO-2003011805-A1 INSECT REPELLENT FULLTEC AG (CH) 2003-02-13 WO disclosed
WO-2002008165-A2 PHENOLIC COMPOUNDS, AND POLYMERS DERIVED THEREFROM GENERAL ELECTRIC COMPANY (US) 2002-01-31 WO disclosed
US-6255438-B1 NOVEL PHENOLIC COMPOUNDS WHICH CAN BE POLYMERIZED WITH AT LEAST ONE DIHYDRIC PHENOL AND CARBONATE PRECURSOR UNDER REACTIVE CONDITIONS TO FORM POLYCARBONATES AND POLYCARBONATEESTER COPOLYMERS GENERAL ELECTRIC COMPANY 2001-07-03 US disclosed
US-5662067-A CLAY, CITRONELLAL CHEROKEE SUN CORPORATION (US) 1997-09-02 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 (2 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-20040265349-A1 Insect repellent WAPL, OSBP, NOTUM CA1 4338/4885GABRP 3832/4885GABRD 3668/4885
US-12552129-B2 Nonwoven water-soluble composite structure SMARCD2, BRWD1, PWWP2B CA1 4486/4885GABRP 3671/4885GABRD 1964/4885

“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.