SCHEMBL17626004

SCHEMBL17626004

CC(=O)Nc1ccc(-c2cs[c]n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.55
▸ HTT P42858 2/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ KMT2A Q03164 11/20 0.54
▸ MEN1 O00255 10/20 0.54
▸ ALDH1A1 P00352 7/20 0.54
▸ MAPT P10636 7/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ HPGD P15428 4/20 0.54
▸ RXFP1 Q9HBX9 2/20 0.54
▸ GAA P10253 3/20 0.51
▸ GFER P55789 1/20 0.51
▸ PRNP P04156 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ RAB9A P51151 7/20 0.48
▸ NPC1 O15118 6/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL17626061 0.84 KIF11 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL17626115 0.84 NPC1 (0.60) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL28212629 0.82 NQO2 (0.52) SMN1; SMN2L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL17626108 0.78 KIF11 (0.40) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL17626288 0.77 NPC1 (0.40) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL17626008 0.73 KDM4E (0.51) SMN1; SMN2HTTKMT2AMEN1ALDH1A1
SCHEMBL3818831 0.73 SMN1; SMN2 (1.00) SMN1; SMN2HTTL3MBTL1KMT2AMEN1
SCHEMBL10515566 0.72 LTA4H (0.46) SMN1; SMN2HTTKMT2AMEN1ALDH1A1
SCHEMBL1916309 0.72 KMT2A (0.47) SMN1; SMN2L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL126387 0.72 KMT2A (0.66) SMN1; SMN2HTTL3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101506180-B Human protein tyrosine phosphatase inhibitors and methods of use PROCTER & GAMBLE 2013-10-30 — — CN claimed
US-20230174533-A1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-06-08 — — US disclosed
US-11555037-B2 Purine diones as Wnt pathway modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-01-17 — — US disclosed
CN-109776537-B Purine diones as WNT pathway modulators 新加坡科技研究局 2021-12-14 — — CN disclosed
US-20210155623-A1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2021-05-27 — — US disclosed
US-10844063-B2 Purine diones as Wnt pathway modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-11-24 — — US disclosed
US-20200190086-A1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-06-18 — — US disclosed
EP-2999699-B1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY SCIENCE TECH & RES (SG) 2020-04-29 — — EP disclosed
US-10472360-B2 Purine diones as Wnt pathway modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-11-12 — — US disclosed
US-20180170932-A1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-06-21 — — US disclosed
US-9926320-B2 Purine diones as Wnt pathway modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-03-27 — — US disclosed
CN-107849013-A It is used for the cyanopyrrole alkanes for the treatment of cancer as DUB inhibitor 特殊治疗有限公司 2018-03-27 — — CN disclosed
US-20170334912-A1 Purine Diones As Wnt Pathway Modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-11-23 — — US disclosed
US-20160090386-A1 Purine Diones As Wnt Pathway Modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-03-31 — — US disclosed
EP-2999699-A1 PURINE DIONES AS WNT PATHWAY MODULATORS Agency For Science, Technology And Research (SG) 2016-03-30 — — EP disclosed
CN-105307498-A Compositions, formulations and methods for treating ocular diseases AERPIO THERAPEUTICS INC 2016-02-03 — — CN disclosed
CN-101506180-B Human protein tyrosine phosphatase inhibitors and methods of use PROCTER & GAMBLE 2013-10-30 — — CN 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 (9 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-20160090386-A1 Purine Diones As Wnt Pathway Modulators WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885
US-20170334912-A1 Purine Diones As Wnt Pathway Modulators WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885
US-10472360-B2 Purine diones as Wnt pathway modulators WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885
US-11555037-B2 Purine diones as Wnt pathway modulators WNT1, WNT3A, WNT3 SMN1; SMN2 4771/4885HTT 3227/4885L3MBTL1 1914/4885
US-20200190086-A1 PURINE DIONES AS WNT PATHWAY MODULATORS WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885
US-20230174533-A1 PURINE DIONES AS WNT PATHWAY MODULATORS WNT1, WNT3A, WNT3 SMN1; SMN2 4771/4885HTT 3227/4885L3MBTL1 1914/4885
US-10844063-B2 Purine diones as Wnt pathway modulators WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885
US-20210155623-A1 PURINE DIONES AS WNT PATHWAY MODULATORS WNT1, WNT3A, WNT3 SMN1; SMN2 4771/4885HTT 3227/4885L3MBTL1 1914/4885
US-20180170932-A1 PURINE DIONES AS WNT PATHWAY MODULATORS WNT1, WNT3A, CTNNB1 SMN1; SMN2 4828/4885HTT 3968/4885L3MBTL1 2626/4885

“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.

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