SCHEMBL9871756

SCHEMBL9871756

Fc1cccc(/C=C/CCl)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 11/20 0.65
PTGS1 P23219 3/20 0.52
PTGS2 P35354 1/20 0.52
NQO2 P16083 1/20 0.50
FBP1 P09467 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
PKM P14618 1/20 0.48
MAPK1 P28482 1/20 0.48
THPO P40225 1/20 0.48
NPC1 O15118 1/20 0.48
CHRM5 P08912 1/20 0.48
GRM5 P41594 1/20 0.48
RAB9A P51151 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
RELA Q04206 1/20 0.47
GRM4 Q14833 1/20 0.41

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
SCHEMBL7294478 1.00 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL17485263 0.85 NFE2L2 (0.41) NFE2L2FBP1CYP1A2NPC1
SCHEMBL700536 0.80 NFE2L2 (1.00) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL700537 0.80 NFE2L2 (1.00) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL31317689 0.80 NFE2L2 (1.00) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL8333086 0.80 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL1431132 0.80 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL1431422 0.80 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL1464098 0.80 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1
SCHEMBL11321270 0.80 NFE2L2 (0.65) NFE2L2PTGS1PTGS2NQO2FBP1

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
JP-61291579-A None JP disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
EP-2925737-B1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY ZAFGEN INC (US) 2017-06-14 EP disclosed
EP-2925737-B1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY ZAFGEN INC (US) 2017-06-14 EP disclosed
US-20160083362-A1 TRICYCLIC SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN, INC. 2016-03-24 US disclosed
US-20160083362-A1 TRICYCLIC SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN, INC. 2016-03-24 US disclosed
US-20160083362-A1 TRICYCLIC SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN, INC. 2016-03-24 US disclosed
EP-2925737-A1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY Zafgen, Inc. (US) 2015-10-07 EP disclosed
WO-2014071369-A1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY ZAFGEN, INC. (US) 2014-05-08 WO disclosed
US-5068325-A Dopaminergic systems as hypotensives, sedatives, antitussives and/or antiphlogistics KARL THOMAE GMBH (DE) 1991-11-26 US disclosed
JP-S61291579-A 1-(3-CINNAMYL)-4-ISOPROPYLCARBAMOYLPIPERAZINE AND PRODUCTION THEREOF KYORIN PHARMACEUT CO LTD 1986-12-22 JP 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 (1 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-20160083362-A1 TRICYCLIC SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME DNPEP, ANPEP, METAP2 NFE2L2 1990/4885PTGS1 1268/4885PTGS2 630/4885

“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.