SCHEMBL1263302

SCHEMBL1263302

CCC1(C(C)CC(C)O)C(=O)NC(=S)NC1=O

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.65
CYP3A4 P08684 3/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GABRB3 P28472 1/20 0.46
OPRD1 P41143 1/20 0.46
GABRA2 P47869 1/20 0.46
GABRB2 P47870 1/20 0.46
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
MMP9 P14780 1/20 0.34
NR1I2 O75469 1/20 0.34
RECQL P46063 1/20 0.32

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
SCHEMBL2730516 0.86 CYP3A4 (0.62) LMNACYP3A4KDM4EALDH1A1GABRB3
SCHEMBL120257 0.82 LMNA (0.73) LMNACYP3A4KDM4EALDH1A1GABRB3
Thiopental SCHEMBL28832536 0.81 LMNA (0.82) LMNACYP3A4KDM4EALDH1A1GABRB3
SCHEMBL122120 0.80 LMNA (0.71) LMNACYP3A4KDM4EALDH1A1GABRB3
SCHEMBL10583723 0.79 LMNA (0.59) LMNACYP3A4KDM4EALDH1A1GABRB3
Thiopental SCHEMBL40814 0.79 LMNA (1.00) LMNACYP3A4KDM4EALDH1A1GABRB3
Thiopental SCHEMBL6688973 0.77 LMNA (0.96) LMNACYP3A4KDM4EALDH1A1GABRB3
SCHEMBL9305362 0.71 CYP3A4 (0.67) LMNACYP3A4KDM4EALDH1A1GABRB3
SCHEMBL10581159 0.69 LMNA (0.56) LMNACYP3A4KDM4EALDH1A1GABRB3
Thiotetrabarbital SCHEMBL2109488 0.67 LMNA (0.67) LMNACYP3A4KDM4EALDH1A1GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240261779-A1 SYSTEMS AND METHODS FOR FLUID SAMPLE COLLECTION AND TESTING Marshall Venture Partners LLC (US) 2024-08-08 US disclosed
US-20230266311-A1 METHOD FOR COLLECTING OROPHARYNGEAL LAVAGE AND DETECTING ANALYTES THEREIN ZEUS DIAGNOSTICS LLC 2023-08-24 US disclosed
US-20220257219-A1 METHOD OF COLLECTING OROPHARYNGEAL LAVAGE, IN VITRO IMMUNOCHROMATOGRAPHIC ASSAY, AND COMPOSITION AND KIT THEREFOR ZEUS DIAGNOSTICS LLC 2022-08-18 US disclosed
US-8940527-B2 Integrated device for analyte testing, confirmation, and donor identity verification LAMINA EQUITIES CORP. (US) 2015-01-27 US disclosed
US-20110144535-A1 Integrated device for analyte testing, confirmation, and donor identity verification SONABANK 2011-06-16 US disclosed
US-7879623-B2 Multicomponent apparatus comprising membrane test strip for use in detection of drugs of abuse in fluid sample LUDWIG & ROBINSON PLLC 2011-02-01 US disclosed
US-20080194041-A1 INTEGRATED DEVICE FOR ANALYTE, TESTING, CONFIRMATION, AND DONOR IDENTITY VERIFICATION LUDWIG & ROBINSON PLLC 2008-08-14 US disclosed