SCHEMBL20425552

SCHEMBL20425552

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

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.69
CYP3A4 P08684 3/20 0.50
GABRB3 P28472 3/20 0.50
GABRA2 P47869 3/20 0.50
GABRB2 P47870 3/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
OPRD1 P41143 1/20 0.50
MMP9 P14780 1/20 0.38
NR1I2 O75469 1/20 0.37
GABRP O00591 2/20 0.35
GABRD O14764 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRB1 P18505 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA4 P48169 2/20 0.35
GABRE P78334 2/20 0.35
GABRA6 Q16445 2/20 0.35

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
SCHEMBL5551525 0.87 GABRB3 (0.67) LMNACYP3A4GABRB3GABRA2GABRB2
Thiopental SCHEMBL40814 0.82 LMNA (1.00) LMNACYP3A4GABRB3GABRA2GABRB2
Thiopental SCHEMBL1611312 0.82 LMNA (1.00) LMNACYP3A4GABRB3GABRA2GABRB2
SCHEMBL120258 0.78 LMNA (0.73) LMNACYP3A4GABRB3GABRA2GABRB2
Thiopental SCHEMBL28832536 0.77 LMNA (0.82) LMNACYP3A4GABRB3GABRA2GABRB2
SCHEMBL122120 0.76 LMNA (0.71) LMNACYP3A4GABRB3GABRA2GABRB2
SCHEMBL122119 0.76 LMNA (0.71) LMNACYP3A4GABRB3GABRA2GABRB2
SCHEMBL10583723 0.71 LMNA (0.59) LMNACYP3A4GABRB3GABRA2GABRB2
Pentobarbital SCHEMBL27743693 0.70 CYP3A4 (0.81) LMNACYP3A4GABRB3GABRA2GABRB2
SCHEMBL7642660 0.69 ALDH1A1 (0.63) LMNACYP3A4GABRB3GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4125614-A1 SYSTEMS AND METHODS FOR FLUID SAMPLE COLLECTION AND TESTING USING A SWAB ASSEMBLY WITH INTEGRAL LATERAL FLOW TEST STRIPS Marshall Venture Partners LLC (US) 2023-02-08 EP disclosed
WO-2022174143-A1 METHOD OF COLLECTING OROPHARYNGEAL LAVAGE, IN VITRO IMMUNOCHROMATOGRAPHIC ASSAY, AND COMPOSITION AND KIT THEREFOR Zeus Diagnostics, LLC (US) 2022-08-18 WO disclosed
WO-2021195633-A1 SYSTEMS AND METHODS FOR FLUID SAMPLE COLLECTION AND TESTING USING A SWAB ASSEMBLY WITH INTEGRAL LATERAL FLOW TEST STRIPS Marshall Venture Partners LLC (US) 2021-09-30 WO disclosed
WO-2018140767-A1 DUAL SWAB FLUID SAMPLE COLLECTION FOR SPLIT SAMPLE TESTING AND FINGERPRINT IDENTIFICATION DEVICE GUIRGUIS RAOUF A (US) 2018-08-02 WO disclosed