SCHEMBL6259983

SCHEMBL6259983

O=C1OC(Cl)(c2ccc(Cl)c(S(=O)(=O)Cl)c2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA3 P07451 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
CFTR P13569 1/20 0.38
GOPC Q9HD26 1/20 0.38
DHFR P00374 4/20 0.38
TYMS P04818 3/20 0.38
LMNA P02545 3/20 0.38
POLB P06746 2/20 0.38

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
SCHEMBL1820782 0.75 CYP2D6 (0.48) MAPTGAAPKMCFTRGOPC
SCHEMBL4726170 0.73 CFTR (0.61) MAPTGAAPKMCFTRGOPC
SCHEMBL1823331 0.71 CFTR (0.46) MAPTGAAPKMCFTRGOPC
SCHEMBL4726524 0.71 CFTR (0.46) MAPTGAAPKMCFTRGOPC
SCHEMBL11011777 0.69 CFTR (0.44) MAPTCFTRGOPCDHFRTYMS
SCHEMBL4728501 0.68 HCAR3 (0.44) MAPTCFTRGOPCLMNATP53
SCHEMBL4727744 0.64 CFTR (0.44) MAPTGAAPKMCFTRGOPC
(R)-Chlorthalidone SCHEMBL30872862 0.63 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL164949 0.63 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL4425734 0.63 CA1 (1.00) MAPTCA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005065046-A2 AN EFFICIENT INDUSTRIAL PROCESS FOR 3-HYDROXY-3-(3’-SULFAMYL-4’-CHLOROPHENYL)PHTALIMIDINE IPCA LABORATORIES LIMITED (IN) 2005-07-21 WO disclosed
US-4322356-A Method of preparing substituted phthalides THE DOW CHEMICAL CO. (US) 1982-03-30 US disclosed
US-4188330-A Substituted phthalide derivatives THE DOW CHEMICAL COMPANY (US) 1980-02-12 US disclosed