SCHEMBL27782853

SCHEMBL27782853

O=S(=O)(O)ON1CCNC1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
GABRA1 P14867 1/20 0.32
TSHR P16473 1/20 0.32
GABRG2 P18507 1/20 0.32
NFKB1 P19838 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRA6 Q16445 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL4097938 0.86 LMNA (0.39) LMNACYP3A4GABRA1TSHRGABRG2
SCHEMBL27656995 0.83 KDM4E (0.30) KDM4E
SCHEMBL28266642 0.82 KDM4E (0.32) KDM4E
Urea SCHEMBL28115595 0.74
SCHEMBL28906292 0.69 LMNA (0.33) LMNACYP3A4GABRA1TSHRGABRG2
SCHEMBL27815720 0.69 PARL (0.49) KDM4E
SCHEMBL27272 0.68 KDM4E (0.37) LMNACYP3A4GABRA1TSHRGABRG2
SCHEMBL8780336 0.68
SCHEMBL1499965 0.67 CA2 (0.36) TSHRKDM4E
SCHEMBL10815069 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107801401-B Cleaning composition with ionic liquid 约翰逊父子公司 2021-06-04 CN disclosed
CN-101723975-A Method for preparing quaternary amine dual-functional ionic liquid CHANGCHUN APPLIED CHEMISTRY 2010-06-09 CN disclosed