SCHEMBL4540282

SCHEMBL4540282

CC1CC2(CCN1S(=O)(=O)c1ccc(-c3ccc4cccnc4c3)cc1)CN(C1CC1)C(=O)CO2

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FASN P49327 9/20 0.77
GSK3B P49841 1/20 0.34
CHRNA7 P36544 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.32
ALOX15 P16050 1/20 0.32
F10 P00742 1/20 0.32
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
HSD11B1 P28845 3/20 0.31

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
SCHEMBL30552767 0.87 FASN (1.00) FASNGSK3BCHRNA7CHRM4CHRM5
SCHEMBL4541971 0.87 FASN (1.00) FASNGSK3BCHRNA7CHRM4CHRM5
SCHEMBL4536444 0.84 FASN (0.93) FASNGSK3BCHRNA7CHRM4CHRM5
SCHEMBL30805670 0.82 FASN (0.87) FASNCHRM5HTR7HTR6HSD11B1
SCHEMBL30805671 0.82 FASN (0.87) FASNCHRM5HTR7HTR6HSD11B1
SCHEMBL15249011 0.82 FASN (0.84) FASNGSK3BCHRNA7CHRM4CHRM5
SCHEMBL4539747 0.81 FASN (0.89) FASNGSK3BCHRM5HTR7HTR6
SCHEMBL4541495 0.80 FASN (0.80) FASNGSK3BCHRNA7CHRM5HTR6
SCHEMBL4543684 0.80 FASN (0.74) FASNGSK3BCHRNA7CHRM4CHRM5
SCHEMBL4533587 0.80 FASN (0.47) FASNHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2637660-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-18 EP claimed
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2013-09-12 US claimed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 WO claimed
WO-2020150423-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS YUMANITY THERAPEUTICS, INC. (US) 2020-07-23 WO disclosed
WO-2020150423-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS YUMANITY THERAPEUTICS, INC. (US) 2020-07-23 WO disclosed
US-20200222400-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2020-07-16 US disclosed
US-20200222400-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2020-07-16 US disclosed
EP-2637660-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-18 EP disclosed
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2013-09-12 US disclosed
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2013-09-12 US disclosed
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2013-09-12 US disclosed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 WO disclosed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 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 (2 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-20200222400-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NLN, CLN6, OTC FASN 2790/4885GSK3B 1573/4885CHRNA7 183/4885
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FASN 1/4885GSK3B 2682/4885CHRNA7 4712/4885

“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.