SCHEMBL6607895

SCHEMBL6607895

OB(O)c1cc2ccc(F)cc2s1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.58
GFER P55789 2/20 0.42
AXL P30530 1/20 0.42
APP P05067 1/20 0.36
ORAI1 Q96D31 1/20 0.35
ORAI2 Q96SN7 1/20 0.35
ORAI3 Q9BRQ5 1/20 0.35
TRPV6 Q9H1D0 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 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
SCHEMBL290043 0.85 MGLL (0.58) MGLL
SCHEMBL29956374 0.85 MGLL (0.58) MGLL
SCHEMBL15191227 0.77 MGLL (0.58) MGLL
SCHEMBL2945825 0.77 MGLL (0.58) MGLLMAPT
SCHEMBL16693111 0.77 MGLL (0.58) MGLLAPPKDM4EMEN1ALDH1A1
SCHEMBL29952719 0.77 MGLL (0.58) MGLLMAPT
SCHEMBL8212 0.74 MGLL (1.00) MGLLAPP
SCHEMBL17001366 0.74 GFER (0.50) GFERAXLAPPKDM4EMEN1
SCHEMBL1612576 0.73 MGLL (0.53) MGLLAPP
SCHEMBL225978 0.73 MGLL (0.53) MGLLAPPMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20170327497-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-11-16 US disclosed
US-9663514-B2 Substituted 6-aza-isoindolin-1-one derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-05-30 US disclosed
EP-2723739-B1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES TAKEDA PHARMACEUTICAL (JP) 2016-08-24 EP disclosed
US-20150274723-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-01 US disclosed
US-9056873-B2 Substituted 6-aza-isoindolin-1-one derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-06-16 US disclosed
US-20140206680-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-24 US disclosed
EP-2723739-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES Takeda Pharmaceutical Company Limited (JP) 2014-04-30 EP disclosed
WO-2012177714-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-27 WO disclosed
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 US disclosed
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 MGLL 2688/4885GFER 2826/4885AXL 2004/4885
US-20150274723-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES SYK, MYD88, BTK MGLL 4165/4885GFER 3595/4885AXL 598/4885
US-20140206680-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES SYK, MYD88, BTK MGLL 4165/4885GFER 3595/4885AXL 598/4885
US-20170327497-A1 SUBSTITUTED 6-AZA-ISOINDOLIN-1-ONE DERIVATIVES SYK, MYD88, BTK MGLL 4165/4885GFER 3595/4885AXL 598/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.