SCHEMBL706083

SCHEMBL706083

O=C(n1nnc2ccccc21)n1nnc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 8/20 0.68
AMY1A P0DUB6 8/20 0.68
GAA P10253 8/20 0.68
SI P14410 8/20 0.68
MGAM2 Q2M2H8 8/20 0.68
KMT2A Q03164 3/20 0.68
F2 P00734 1/20 0.68
HPGD P15428 1/20 0.68
SLC9A1 P19634 1/20 0.68
DGAT1 O75907 1/20 0.66
FAAH O00519 5/20 0.62
MGLL Q99685 5/20 0.62
KCNMA1 Q12791 1/20 0.62
F12 P00748 5/20 0.60
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
MIF P14174 1/20 0.55

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
SCHEMBL4250719 0.88 GAA (0.68) MGAMAMY1AGAASIMGAM2
SCHEMBL19357103 0.87 FAAH (0.81) FAAHMGLL
SCHEMBL170673 0.86 GAA (0.71) MGAMAMY1AGAASIMGAM2
SCHEMBL1756653 0.86 DGAT1 (0.69) MGAMAMY1AGAASIMGAM2
SCHEMBL425580 0.84 FAAH (0.72) FAAHMGLL
SCHEMBL443789 0.84 MGAM (0.55) MGAMAMY1AGAASIMGAM2
SCHEMBL3840404 0.84 GAA (0.69) MGAMAMY1AGAASIMGAM2
Ammonia Solution, Strong SCHEMBL3505685 0.84 GAA (0.69) MGAMAMY1AGAASIMGAM2
SCHEMBL10621117 0.84 GAA (0.64) MGAMAMY1AGAASIMGAM2
SCHEMBL427058 0.84 GAA (0.64) MGAMAMY1AGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174671-A1 New 2,3-Dihydro-1H-pyrrolo[3,2-b]pyridine Derivatives as Sigma Ligands ACONDICIONAMIENTO TARRASENSE (ES) 2024-05-30 US claimed
CN-117480161-A Novel 2, 3-dihydro-1H-pyrrolo [3,2-b ] pyridine derivatives as sigma ligands 塔拉森调理公司 2024-01-30 CN claimed
EP-4305029-A1 NEW 2,3-DIHYDRO-1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVES AS SIGMA LIGANDS Acondicionamiento Tarrasense (ES) 2024-01-17 EP claimed
CN-117386893-A Multilayer composite antibacterial PE water supply pipeline and preparation process thereof 江苏惠升管业集团有限公司 2024-01-12 CN claimed
CN-117229840-A Water-based memory metal wiredrawing liquid and application thereof 广州亦盛环保科技有限公司 2023-12-15 CN claimed
US-20220411374-A1 ALTERNATE PROCESSES FOR THE PREPARATION OF OMECAMTIV MECARBIL DR. REDDY'S LABORATORIES LIMITED (IN) 2022-12-29 US claimed
WO-2022189392-A1 NEW 2,3-DIHYDRO-1H-PYRROLO[3,2-b]PYRIDINE DERIVATIVES AS SIGMA LIGANDS ACONDICIONAMIENTO TARRASENSE (ES) 2022-09-15 WO claimed
US-11424006-B2 Targeted drugs associated with trimethylamine and/or trimeihylamine-n-oxide PSOMAGEN, INC. (US) 2022-08-23 US claimed
US-20210128498-A1 TARGETED DRUGS ASSOCIATED WITH TRIMETHYLAMINE AND/OR TRIMETHYLAMINE-N-OXIDE MACROGEN INC. (KR) 2021-05-06 US claimed
WO-2021070124-A1 ALTERNATE PROCESSES FOR THE PREPARATION OF OMECAMTIV MECARBIL DR. REDDY’S LABORATORIES LIMITED (IN) 2021-04-15 WO claimed
WO-2016030669-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN CIPLA LIMITED (IN) 2016-03-03 WO claimed
US-9006480-B2 Process for producing isocyanates 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-04-14 US claimed
CN-102844297-B method for producing isocyanates 3M INNOVATIVE PROPERTIES CO 2014-12-10 CN claimed
US-20130023694-A1 PROCESS FOR PRODUCING ISOCYANATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-01-24 US claimed
EP-2377847-A1 Process for producing isocyanates 3M Innovative Properties Company (US) 2011-10-19 EP claimed
EP-2014797-A2 Coating composition for interconnection part of electrode and plasma display panel including the same Samsung SDI Co., Ltd. (KR) 2009-01-14 EP claimed
EP-1490409-B1 MODIFIED SACCHARIDES HAVING IMPROVED STABILITY IN WATER NOVARTIS VACCINES & DIAGNOSTIC (IT) 2008-12-31 EP claimed
US-20080303439-A1 Coating composition for interconnection part of electrode and plasma display panel including the same SAMSUNG SDI CO., LTD., A CORP. OF THE REPUBLIC OF KOREA (KR) 2008-12-11 US claimed
EP-0928311-B1 SHAPING OBJECT WITH REACTIVE FUNCTIONS BIOTECHNOLOG FORSCHUNG GMBH (DE) 2003-04-09 EP claimed
US-4224439-A Activated matrix and method of activation DEVELOPMENT FINANCE CORPORATION OF NEW ZEALAND (NZ) 1980-09-23 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-11424006-B2 Targeted drugs associated with trimethylamine and/or trimeihylamine-n-oxide PNMT, MAOA, HNMT MGAM 38/4885AMY1A 2168/4885GAA 346/4885
US-20220411374-A1 ALTERNATE PROCESSES FOR THE PREPARATION OF OMECAMTIV MECARBIL SI, UMPS, OTC MGAM 13/4885AMY1A 2048/4885GAA 995/4885
US-20210128498-A1 TARGETED DRUGS ASSOCIATED WITH TRIMETHYLAMINE AND/OR TRIMETHYLAMINE-N-OXIDE MAOA, PNMT, HNMT MGAM 28/4885AMY1A 1487/4885GAA 179/4885
US-20240174671-A1 New 2,3-Dihydro-1H-pyrrolo[3,2-b]pyridine Derivatives as Sigma Ligands SIGMAR1, OPRD1, TMEM97 MGAM 4652/4885AMY1A 3139/4885GAA 3874/4885
US-20130023694-A1 PROCESS FOR PRODUCING ISOCYANATES IDH2, IDH1, IDH3A MGAM 116/4885AMY1A 1506/4885GAA 1167/4885

“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.