SCHEMBL9528476

SCHEMBL9528476

N#Cc1ccc(NC(=S)NC2CCCCCCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.69
SMN1; SMN2 Q16637 11/20 0.66
LMNA P02545 7/20 0.66
NPSR1 Q6W5P4 2/20 0.66
ALOX12 P18054 5/20 0.64
RAB9A P51151 4/20 0.63
NPC1 O15118 2/20 0.63
POLB P06746 2/20 0.63
CYP1A2 P05177 2/20 0.63
CYP2C19 P33261 2/20 0.63
CYP3A4 P08684 1/20 0.63
MEN1 O00255 8/20 0.62
KMT2A Q03164 8/20 0.62
MAPT P10636 6/20 0.62
GAA P10253 2/20 0.62
MAPK1 P28482 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
HTT P42858 7/20 0.61
ALDH1A1 P00352 4/20 0.58
TP53 P04637 1/20 0.58

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
SCHEMBL18695079 1.00 EPHX1 (0.69) EPHX1SMN1; SMN2LMNANPSR1ALOX12
SCHEMBL10531842 1.00 EPHX1 (0.69) EPHX1SMN1; SMN2LMNANPSR1ALOX12
SCHEMBL28756963 0.87 SMN1; SMN2 (0.83) SMN1; SMN2LMNANPSR1ALOX12RAB9A
SCHEMBL9530001 0.84 EPHX1 (0.50) EPHX1SMN1; SMN2LMNANPSR1ALOX12
SCHEMBL9755532 0.82 EPHX1 (1.00) EPHX1SMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL18737536 0.82 EPHX1 (0.69) EPHX1SMN1; SMN2LMNANPSR1RAB9A
SCHEMBL14506148 0.82 EPHX1 (1.00) EPHX1SMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL2752610 0.80 EPHX1 (0.97) EPHX1SMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL11697622 0.80 NPSR1 (1.00) EPHX1SMN1; SMN2LMNANPSR1ALOX12
SCHEMBL11149053 0.80 SMN1; SMN2 (0.97) EPHX1SMN1; SMN2LMNANPSR1ALOX12

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118791405-A Synthesis method of (E) - (N' - (4-cyanophenyl) -N-cyclooctylcarbamoylamino) -2-glycine 郑州大学 2024-10-18 CN claimed
CN-106456592-B Sweet receptor antagonist 味之素株式会社 2019-06-18 CN claimed
US-9907766-B2 Sweetness receptor antagonist AJINOMOTO CO., INC. (JP) 2018-03-06 US claimed
EP-3162366-A1 SWEETNESS RECEPTOR ANTAGONIST Ajinomoto Co., Inc. (JP) 2017-05-03 EP claimed
US-20170101372-A1 SWEETNESS RECEPTOR ANTAGONIST AJINOMOTO CO., INC. (JP) 2017-04-13 US claimed
CN-106456592-A Sweetness receptor antagonist 味之素株式会社 2017-02-22 CN claimed
CN-118791405-A Synthesis method of (E) - (N' - (4-cyanophenyl) -N-cyclooctylcarbamoylamino) -2-glycine 郑州大学 2024-10-18 CN disclosed
CN-118791405-A Synthesis method of (E) - (N' - (4-cyanophenyl) -N-cyclooctylcarbamoylamino) -2-glycine 郑州大学 2024-10-18 CN disclosed
CN-106456592-B Sweet receptor antagonist 味之素株式会社 2019-06-18 CN disclosed
US-9907766-B2 Sweetness receptor antagonist AJINOMOTO CO., INC. (JP) 2018-03-06 US disclosed
US-9907766-B2 Sweetness receptor antagonist AJINOMOTO CO., INC. (JP) 2018-03-06 US disclosed
US-9907766-B2 Sweetness receptor antagonist AJINOMOTO CO., INC. (JP) 2018-03-06 US disclosed
EP-3162366-A1 SWEETNESS RECEPTOR ANTAGONIST Ajinomoto Co., Inc. (JP) 2017-05-03 EP disclosed
US-20170101372-A1 SWEETNESS RECEPTOR ANTAGONIST AJINOMOTO CO., INC. (JP) 2017-04-13 US disclosed
US-20170101372-A1 SWEETNESS RECEPTOR ANTAGONIST AJINOMOTO CO., INC. (JP) 2017-04-13 US disclosed
US-20170101372-A1 SWEETNESS RECEPTOR ANTAGONIST AJINOMOTO CO., INC. (JP) 2017-04-13 US disclosed
CN-106456592-A Sweetness receptor antagonist 味之素株式会社 2017-02-22 CN disclosed
EP-0299533-B1 HIGH POTENCY SWEETENING AGENTS THE NUTRASWEET COMPANY (a Delaware corporation) (US) 1993-04-07 EP disclosed
WO-1989000563-A1 HIGH POTENCY SWEETENING AGENTS THE NUTRASWEET COMPANY (US) 1989-01-26 WO disclosed
EP-0299533-A2 High potency sweetening agents THE NUTRASWEET COMPANY (a Delaware corporation) (US) 1989-01-18 EP 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-20170101372-A1 SWEETNESS RECEPTOR ANTAGONIST GPR119, GLP1R, SUCNR1 EPHX1 4300/4885SMN1; SMN2 3734/4885LMNA 4812/4885

“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.