SCHEMBL11244635

SCHEMBL11244635

CS(=O)(=O)OCCOCC1CC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.44
TSHR P16473 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MMP9 P14780 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL25957672 0.91 KDM4E (0.38) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL25957699 0.91 KDM4E (0.38) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL25957611 0.91 KDM4E (0.38) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL16409795 0.81 SMN1; SMN2 (0.43) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL14414058 0.80 USP2 (0.42) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL1062380 0.80
SCHEMBL7705221 0.80 USP2 (0.42) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL12268019 0.77
SCHEMBL4143916 0.77 USP2 (0.63) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL4149480 0.77 USP2 (0.63) USP2TSHRKDM4EALDH1A1LMNA

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
US-4311708-A ADRENERGIC BLOCKING AGENTS SYNTHELABO (FR) 1982-01-19 US disclosed
US-4252984-A 1-/P-/2-/CYCLOPROPYLMETHOXY/ETHYL/PHENOXY/-3-ISOPROPYLAMINO-2 -PROPANOL SYNTHELABO (FR) 1981-02-24 US disclosed