SCHEMBL1049958

SCHEMBL1049958

Brc1ccn2cncc2c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.43
PRKCI P41743 1/20 0.41
IDO1 P14902 1/20 0.35
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
NAMPT P43490 1/20 0.32
CYP11B1 P15538 1/20 0.32
ADRA2C P18825 1/20 0.32
CYP11B2 P19099 1/20 0.32
CHRNA7 P36544 1/20 0.31
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
HTR2A P28223 1/20 0.30
HTR7 P34969 1/20 0.30
HTR6 P50406 1/20 0.30
NR3C1 P04150 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
SCHEMBL15246478 0.75 TBXAS1 (0.43) TBXAS1PRKCIIDO1BRD4CREBBP
SCHEMBL12093717 0.75 TBXAS1 (0.43) TBXAS1PRKCIIDO1BRD4CREBBP
SCHEMBL24339261 0.71 TBXAS1 (0.57) TBXAS1PRKCIIDO1BRD4CREBBP
SCHEMBL30951194 0.71 TBXAS1 (0.43) TBXAS1PRKCIIDO1BRD4CREBBP
SCHEMBL24423211 0.71 TBXAS1 (0.40) TBXAS1PRKCIIDO1CYP11B1CYP11B2
SCHEMBL13931946 0.71 QPCT (0.43) TBXAS1PRKCIBRD4CREBBPCYP11B1
SCHEMBL1759118 0.69 TBXAS1 (0.52) TBXAS1PRKCIIDO1NAMPTNR3C1
SCHEMBL19203784 0.68 TBXAS1 (0.58) TBXAS1PRKCIIDO1BRD4CREBBP
Hydrochloric Acid SCHEMBL15232586 0.68 TBXAS1 (0.51) TBXAS1PRKCIIDO1NAMPTNR3C1
SCHEMBL29986327 0.68 TBXAS1 (0.48) TBXAS1PRKCINAMPTHTR1ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026098632-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 江苏恒瑞医药股份有限公司 2026-05-15 WO disclosed
CN-122055363-A Compounds and methods for modulating splicing 雷密克斯医疗公司 2026-05-15 CN disclosed
US-12606541-B2 PPARg modulators and methods of use EISAI R&D MANAGEMENT CO., LTD. (JP) 2026-04-21 US disclosed
EP-4724438-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2026-04-15 EP disclosed
US-20250320212-A1 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS INCYTE CORP (US) 2025-10-16 US disclosed
US-12441724-B2 Inhibitors of plasma kallikrein and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-10-14 US disclosed
EP-4620469-A2 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS Incyte Corporation (US) 2025-09-24 EP disclosed
US-20250282785-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2025-09-11 US disclosed
EP-4175719-B1 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS INCYTE CORP (US) 2025-05-21 EP disclosed
EP-4522608-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE JANSSEN Pharmaceutica NV (BE) 2025-03-19 EP disclosed
WO-2014008197-A1 HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS 3-V BIOSCIENCES, INC. (US) 2014-01-09 WO disclosed
WO-2013148603-A1 CINNOLINE DERIVATIVES AS AS BTK INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-10-03 WO disclosed
US-7868036-B2 Organic compounds NOVARTIS AG (CH) 2011-01-11 US disclosed
US-7851634-B2 5-amino 4-hydroxy-7-(1H-indolmethyl)-8-methylnonamide derivatives as renin inhibitors for the treatment of hypertension NOVARTIS AG (CH) 2010-12-14 US disclosed
US-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension NOVARTIS AG (CH) 2008-11-13 US disclosed
US-20080058320-A1 Organic Compounds NOVARTIS AG (CH) 2008-03-06 US disclosed
EP-1725530-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2006-11-29 EP disclosed
EP-1699762-A1 5-AMINO-4-HYDROXY-7-(1H-INDOLMETHYL)-8-METHYLNONAMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION Speedel Experimenta AG (CH) 2006-09-13 EP disclosed
WO-2005090304-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 WO disclosed
WO-2005090305-A1 5-AMINO-4-HYDROXY-7-(1H-INDOLMETHYL)-8-METHYLNONAMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 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 (6 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-20250320212-A1 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS JAK2, JAK1, JAK3 TBXAS1 1085/4885PRKCI 135/4885IDO1 2332/4885
US-20080280895-A1 5-Amino-4-Hydroxy-7-(1H-Indolmethyl)-8-Methylnonamide Derivatives as Renin Inhibitors for the Treatment of Hypertension REN, AGTR1, AGTR2 TBXAS1 1247/4885PRKCI 1470/4885IDO1 828/4885
US-12441724-B2 Inhibitors of plasma kallikrein and uses thereof KLKB1, KLK1, KLK5 TBXAS1 1172/4885PRKCI 1464/4885IDO1 1970/4885
US-20250282785-A1 PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE NFKBIA, IKBKG, IKBKB TBXAS1 1128/4885PRKCI 24/4885IDO1 867/4885
US-12606541-B2 PPARg modulators and methods of use PPARG, PPARA, PPARD TBXAS1 537/4885PRKCI 1115/4885IDO1 2570/4885
US-20080058320-A1 Organic Compounds REN, AGTR1, ADH1C TBXAS1 1492/4885PRKCI 3580/4885IDO1 2677/4885

“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.