Sugi Predict

Sugi Predict / Compounds / SCHEMBL343674

SCHEMBL343674

SCHEMBL343674

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@H]2O[C@@H](n3ccc(NC(=O)c4ccccc4)nc3=O)C[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.45
▸ ABL1 P00519 1/20 0.40
▸ RIN1 Q13671 1/20 0.40
▸ P2RY6 Q15077 3/20 0.35
▸ P2RY14 Q15391 2/20 0.35
▸ NT5E P21589 1/20 0.35
▸ P2RY2 P41231 1/20 0.31
▸ P2RY4 P51582 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL440942 0.94 POLB (0.38) POLBABL1RIN1
SCHEMBL1539812 0.89 POLB (0.46) POLBABL1RIN1P2RY6P2RY14
SCHEMBL8501966 0.87 P2RY6 (0.38) POLBABL1RIN1P2RY6P2RY14
SCHEMBL7202966 0.86 POLB (0.47) POLBABL1RIN1P2RY6P2RY14
SCHEMBL9913496 0.85 POLB (0.54) POLBABL1RIN1P2RY6P2RY14
SCHEMBL12017694 0.85 POLB (0.50) POLBABL1RIN1P2RY6P2RY14
SCHEMBL8658428 0.85 POLB (0.49) POLBABL1RIN1P2RY6P2RY14
SCHEMBL6275167 0.85 POLB (0.41) POLBABL1RIN1P2RY6P2RY14
SCHEMBL25512063 0.84 POLB (0.33) POLBADORA3
SCHEMBL15496851 0.84 POLB (0.43) POLBABL1RIN1P2RY6P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10670584-B2 In vitro methods of detecting heteroligomeric T1R2/T2R3-expressing cells that are potentially sensitive to sweet tastants FIRMENICH INCORPORATED (US) 2020-06-02 — — US disclosed
US-10597437-B2 T1R taste receptors and genes encoding same FIRMENICH INCORPORATED (US) 2020-03-24 — — US disclosed
US-10591464-B2 Methods of using T1R hetero-oligomeric taste receptors to screen for compounds which modulate sweet or umami taste signaling FIRMENICH INCORPORATED (US) 2020-03-17 — — US disclosed
US-20200049699-A1 T1R HETERO-OLIGOMERIC TASTE RECEPTORS, CELL LINES THAT EXPRESS SAID RECEPTORS, AND TASTE COMPOUNDS SENOMYX, INC. 2020-02-13 — — US disclosed
US-20200033368-A1 T2R Taste Receptors and Genes Encoding Same SENOMYX, INC. 2020-01-30 — — US disclosed
EP-2327985-B2 T1R Hetero-oligomeric taste receptors and cell lines that express said receptors and use thereof for identification of taste compounds SENOMYX INC (US) 2019-08-21 — — EP disclosed
US-10352929-B2 T1R hetero-oligomeric taste receptors, cell lines that express said receptors, and taste compounds SENOMYX, INC. (US) 2019-07-16 — — US disclosed
US-20190212329-A1 T1R HETERO-OLIGOMERIC TASTE RECEPTORS SENOMYX, INC. 2019-07-11 — — US disclosed
US-10324098-B2 T2R taste receptors and genes encoding same SENOMYX, INC. (US) 2019-06-18 — — US disclosed
US-20190086393-A1 T1R HETERO-OLIGOMERIC TASTE RECEPTORS AND CELL LINES THAT EXPRESS SAID RECEPTORS AND USE THEREOF FOR IDENTIFICATION OF TASTE COMPOUNDS SENOMYX, INC. 2019-03-21 — — US disclosed
WO-2003001876-A2 T1R HETERO-OLIGOMERIC TASTE RECEPTORS AND CELL LINES THAT EXPRESS SAID RECEPTORS AND USE THEREOF FOR IDENTIFICATION OF TASTE COMPOUNDS SENOMYX, INC. (US) 2003-01-09 — — WO disclosed
US-20030008344-A1 T1R taste receptors and genes encoding same FIRMENICH INCORPORATED 2003-01-09 — — US disclosed
US-6492143-B1 A KIT FOR AMPLIFICATION OF OLFACTORY RECEPTOR SEQUENCES COMPRISING THE PRIMER PAIR; GENERATING NUCLEIC ACID SEQUENCE THAT ENCODES A LIGAND-BINDING REGION OF AN OLFACTORY RECEPTOR, THE METHOD COMPRISING AMPLIFICATION OF A NUCLEIC ACID USING A THE JOHN HOPKINS UNIVERSITY 2002-12-10 — — US disclosed
US-20020160424-A1 T1R hetero-oligomeric taste receptors FIRMENICH INCORPORATED 2002-10-31 — — US disclosed
WO-2002064631-A2 T1R TASTE RECEPTORS AND GENES ENCODING SAME SENOMYX, INC. (US) 2002-08-22 — — WO disclosed
US-20020094551-A1 T2R taste receptors and genes ecncoding same FIRMENICH INCORPORATED 2002-07-18 — — US disclosed
US-6379931-B1 Chimeric DNA/RNA ribozymes containing propanediol CITY OF HOPE 2002-04-30 — — US disclosed
WO-2001068805-A2 HUMAN OLFACTORY RECEPTORS AND GENES ENCODING SAME SENOMYX, INC. (US) 2001-09-20 — — WO disclosed
WO-2001066563-A2 T1R TASTE RECEPTORS AND GENES ENCODING SAME SENOMYX, INC. (US) 2001-09-13 — — WO disclosed
WO-2000035274-A1 OLFACTORY RECEPTOR EXPRESSION LIBRARIES AND METHODS OF MAKING AND USING THEM THE JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE (US) 2000-06-22 — — 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-20200049699-A1 T1R HETERO-OLIGOMERIC TASTE RECEPTORS, CELL LINES THAT EXPRESS SAID RECEPTORS, AND TASTE COMPOUNDS TAS1R2, TAS1R1, TAS2R1 POLB 4861/4885ABL1 4693/4885RIN1 465/4885
US-10352929-B2 T1R hetero-oligomeric taste receptors, cell lines that express said receptors, and taste compounds TAS1R2, TAS1R1, TAS2R1 POLB 4861/4885ABL1 4693/4885RIN1 465/4885

“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.