SCHEMBL4718489

SCHEMBL4718489

O=C(O)c1cccn2cncc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.54
TDO2 P48775 1/20 0.54
TBXAS1 P24557 2/20 0.52
DHODH Q02127 2/20 0.42
QPCT Q16769 1/20 0.42
QPCTL Q9NXS2 1/20 0.42
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALOX15 P16050 2/20 0.40
MGLL Q99685 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
MYC P01106 2/20 0.36
NR4A1 P22736 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36

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
SCHEMBL27598650 0.86 IDO1 (0.50) IDO1TDO2TBXAS1DHODHQPCT
SCHEMBL4719784 0.77 TSHR (0.51) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL25514677 0.77 ALDH1A1 (0.50) DHODHALDH1A1KDM4ETDP1ALOX15
SCHEMBL18137568 0.76 QPCT (0.44) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL18137658 0.76 IDO1 (0.42) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL4719669 0.75 IDO1 (0.74) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL9656910 0.74 QPCT (0.59) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL9934392 0.73 IDO1 (0.47) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL4219167 0.73 IDO1 (0.47) IDO1TDO2TBXAS1QPCTQPCTL
SCHEMBL8829243 0.73 KDM4C (0.43) ALDH1A1KDM4ETDP1MGLLL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856179-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-05-13 EP disclosed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
EP-3856178-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-03-11 EP disclosed
US-20240327410-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2024-10-03 US disclosed
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 CN disclosed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN disclosed
US-11993601-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV 2024-05-28 US disclosed
WO-2024107778-A1 NOVEL PROTEASE INHIBITORS FOR TREATMENT OF CORONAVIRUS INFECTIONS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-05-23 WO disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230242531-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 US disclosed
US-20180072716-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEONE MEDICINES I GMBH (CH) 2018-03-15 US disclosed
US-20180072716-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEONE MEDICINES I GMBH (CH) 2018-03-15 US disclosed
US-20180072716-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEONE MEDICINES I GMBH (CH) 2018-03-15 US disclosed
WO-2016161960-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO [1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEIGENE, LTD. (KY) 2016-10-13 WO disclosed
US-7442701-B2 Amino-heterocycles as VR-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2008-10-28 US disclosed
EP-1562934-B1 AMINO-HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME (GB) 2008-03-26 EP disclosed
US-20070078156-A1 Derivatives of n-(1h-indazolyl)-and n-(1h-indolyl)-urea as well as related compounds as modulators of the vanilloid-1 receptor (vr1) for treatment of pain MERCK SHARP & DOHME LTD. (GB) 2007-04-05 US disclosed
EP-1675587-A2 DERIVATIVES OF N-(1H-INDAZOLYL)- AND N-(1H-INDOLYL)-UREA AS WELL AS RELATED COMPOUNDS AS MODULATORS OF THE VANILLOID-1 RECEPTOR (VR1) FOR THE TREATMENT OF PAIN MERCK SHARP & DOHME LTD. (GB) 2006-07-05 EP disclosed
US-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2006-02-23 US disclosed
WO-2005028445-A2 DERIVATIVES OF N-(1H-INDAZOLYL)- AND N-(1H-INDOLYL)-UREA AS WELL AS RELATED COMPOUNDS AS MODULATORS OF THE VANILLOID-1 RECEPTOR (VR1) FOR THE TREATMENT OF PAIN MERCK SHARP & DOHME LIMITED (GB) 2005-03-31 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 (8 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-20070078156-A1 Derivatives of n-(1h-indazolyl)-and n-(1h-indolyl)-urea as well as related compounds as modulators of the vanilloid-1 receptor (vr1) for treatment of pain CNR1, OPRL1, SIGMAR1 IDO1 1755/4885TDO2 1920/4885TBXAS1 1282/4885
US-20230242531-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP IDO1 1745/4885TDO2 3784/4885TBXAS1 1827/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH IDO1 1215/4885TDO2 1247/4885TBXAS1 1547/4885
US-11993601-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP IDO1 1745/4885TDO2 3784/4885TBXAS1 1827/4885
US-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain OPRL1, CNR1, GPR6 IDO1 1897/4885TDO2 765/4885TBXAS1 1739/4885
US-20240327410-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP IDO1 1745/4885TDO2 3784/4885TBXAS1 1827/4885
US-20180072716-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1, 5-a] PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES IDO1, TPH1, IDO2 IDO1 1/4885TDO2 5/4885TBXAS1 345/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP IDO1 1973/4885TDO2 3858/4885TBXAS1 1502/4885

“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.