SCHEMBL11075928

SCHEMBL11075928

COc1ccc(C2(c3ccc(OC)cc3)NS(=O)(=O)c3ccccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.43
KMT2A Q03164 7/20 0.42
MAPT P10636 4/20 0.42
KDM4E B2RXH2 3/20 0.42
POLB P06746 3/20 0.42
ALPL P05186 1/20 0.39
ALPI P09923 1/20 0.39
MAPK1 P28482 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 4/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP2C9 P11712 1/20 0.37
AGTR1 P30556 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36

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
SCHEMBL11248429 0.80 MEN1 (0.50) KMT2AMAPTKDM4ELMNAHTT
SCHEMBL11128885 0.72 SLC40A1 (0.31) KMT2AMAPTKDM4EPOLB
SCHEMBL17814239 0.68 ATM (0.47) ATMKMT2AMAPTKDM4EMAPK1
SCHEMBL11237723 0.65 MAPT (0.43) KMT2AMAPTKDM4EPOLBMAPK1
SCHEMBL31536367 0.65 KMT2A (0.36) KMT2AMAPTKDM4EPOLBLMNA
SCHEMBL17169742 0.64 KMT2A (0.39) KMT2AKDM4ELMNAMEN1CYP2C9
SCHEMBL26048255 0.64 KMT2A (0.39) KMT2AKDM4ELMNAMEN1CYP2C9
SCHEMBL5523699 0.64 KMT2A (0.39) KMT2AKDM4EMAPK1LMNAMEN1
SCHEMBL31276971 0.64 ATM (0.53) ATMKMT2AMAPTKDM4EPOLB
SCHEMBL7685977 0.64 KMT2A (0.35) KMT2AKDM4ELMNAMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001290-B1 SUBSTITUTED 2,3-DIHYDROBENZ-(D)-ISOTHIAZOLE-1,1-DIOXIDES AND 2,3-DIHYDRONAPHTHO-(1,8-DE)-1,2-THIAZINE-1,1-DIOXIDES POLAROID CORPORATION (US) 1984-06-27 EP disclosed
US-4359574-A Thiazine-1,1-dioxide and isothiazole-1,1-dioxide derivatives POLAROID CORPORATION (US) 1982-11-16 US disclosed
US-4259498-A Process for preparing benzisothiazole-1,1-dioxide and naphtho-1,2-thiazine-1,1-dioxide compounds POLAROID CORPORATION (US) 1981-03-31 US disclosed
US-4204061-A Sulfam(na)phthaleins POLAROID CORPORATION (US) 1980-05-20 US disclosed
US-4191689-A Benzisothiazole-1,1-dioxide and naphtho-1,2-thiazine-1,1-dioxide compounds POLAROID CORPORATION (US) 1980-03-04 US disclosed
EP-0001290-A1 Substituted 2,3-dihydrobenz-(d)-isothiazole-1,1-dioxides and 2,3-dihydronaphtho-(1,8-de)-1,2-thiazine-1,1-dioxides POLAROID CORPORATION (US) 1979-04-04 EP disclosed