SCHEMBL4543592

SCHEMBL4543592

O=C1COC2(CCN(S(=O)(=O)c3ccc(-c4ccc5cccnc5c4)c(F)c3)CC2)CN1C1CC1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FASN P49327 7/20 0.81
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
KDM1A O60341 1/20 0.37
FEN1 P39748 7/20 0.36
ALOX5AP P20292 6/20 0.36
CHRM5 P08912 1/20 0.36
JAK2 O60674 1/20 0.35
ADRB3 P13945 1/20 0.34
CHRNA7 P36544 1/20 0.34

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
SCHEMBL4540792 0.92 FASN (0.82) FASNHTR7HTR6KDM1ACHRM5
SCHEMBL4543118 0.91 FASN (0.81) FASNHTR7HTR6CHRM5ADRB3
SCHEMBL4537999 0.91 FASN (0.81) FASNHTR7HTR6KDM1ACHRM5
SCHEMBL4536954 0.90 FASN (0.78) FASNHTR7HTR6CHRM5ADRB3
SCHEMBL4541541 0.90 FASN (0.74) FASNHTR6KDM1AFEN1ALOX5AP
SCHEMBL4541971 0.90 FASN (1.00) FASNHTR7HTR6CHRM5CHRNA7
SCHEMBL30552767 0.90 FASN (1.00) FASNHTR7HTR6CHRM5CHRNA7
SCHEMBL4541959 0.89 FASN (0.79) FASNHTR7HTR6CHRM5ADRB3
SCHEMBL4537375 0.87 FASN (0.80) FASNKDM1AFEN1ALOX5APCHRM5
SCHEMBL4536444 0.86 FASN (0.93) FASNHTR7HTR6CHRM5CHRNA7

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
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
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 2790/4885HTR7 1522/4885HTR6 750/4885
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FASN 1/4885HTR7 3274/4885HTR6 2872/4885

“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.