SCHEMBL29664474

SCHEMBL29664474

Cc1cc2nc3ccccc3cc2c(-c2ccccc2)c1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.58
ESR2 Q92731 7/20 0.58
PDE10A Q9Y233 2/20 0.51
ALDH1A1 P00352 3/20 0.45
GLA P06280 2/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 2/20 0.45
POLB P06746 2/20 0.45
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
PTBP1 P26599 1/20 0.45
RCE1 Q9Y256 1/20 0.45
NQO2 P16083 1/20 0.44
MAPT P10636 2/20 0.44
ACHE P22303 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.40

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
SCHEMBL29177963 0.84 ESR1 (0.46) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL7253564 0.84 ESR1 (0.55) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL7126854 0.84 ALDH1A1 (0.46) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL28861333 0.83 ESR1 (0.57) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL30527881 0.81 ALDH1A1 (0.52) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL9755342 0.81 ALDH1A1 (0.52) ESR1ESR2PDE10AALDH1A1GLA
Biphenyl SCHEMBL28506015 0.77 PDE10A (0.54) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL28441223 0.77 ESR1 (0.62) ESR1ESR2PDE10AALDH1A1GLA
SCHEMBL28375096 0.76 ALOX5 (0.44) ESR1ESR2PDE10AALDH1A1HPGD
SCHEMBL14677000 0.75 CYP1A2 (0.45) ESR1ESR2PDE10AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122060343-A Marker comprising dibromopyridazindione for immunoassays and methods of making and using the same 美国西门子医学诊断股份有限公司 2026-05-19 CN claimed
US-20260008819-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2026-01-08 US claimed
EP-4638467-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF Siemens Healthcare Diagnostics Inc. (US) 2025-10-29 EP claimed
WO-2025096611-A1 REAGENT COMPOSITIONS FOR IMMUNOASSAYS AND USE OF THE SAME IN DETECTION OF CANCER ANTIGEN 19-9 SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2025-05-08 WO claimed
WO-2024137034-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2024-06-27 WO claimed
US-20240010841-A1 LABELS COMPRISING DIBROMOPYRIDAZINEDIONES FOR IMMUNOASSAYS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2024-01-11 US claimed
WO-2022126055-A1 LABELS COMPRISING DIBROMOPYRIDAZINEDIONES FOR IMMUNOASSAYS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2022-06-16 WO claimed
CN-122060343-A Marker comprising dibromopyridazindione for immunoassays and methods of making and using the same 美国西门子医学诊断股份有限公司 2026-05-19 CN disclosed
US-20260008819-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2026-01-08 US disclosed
EP-4638467-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF Siemens Healthcare Diagnostics Inc. (US) 2025-10-29 EP disclosed
WO-2025096611-A1 REAGENT COMPOSITIONS FOR IMMUNOASSAYS AND USE OF THE SAME IN DETECTION OF CANCER ANTIGEN 19-9 SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2025-05-08 WO disclosed
WO-2024137034-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2024-06-27 WO disclosed
US-20240010841-A1 LABELS COMPRISING DIBROMOPYRIDAZINEDIONES FOR IMMUNOASSAYS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2024-01-11 US disclosed
WO-2022126055-A1 LABELS COMPRISING DIBROMOPYRIDAZINEDIONES FOR IMMUNOASSAYS AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2022-06-16 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-20260008819-A1 CYCLOSPORINE-ACRIDINIUM ESTERS AND METHODS OF PRODUCTION AND USE THEREOF CYCS, CHP1, IL2RA ESR1 2510/4885ESR2 1121/4885PDE10A 4450/4885
US-20240010841-A1 LABELS COMPRISING DIBROMOPYRIDAZINEDIONES FOR IMMUNOASSAYS AND METHODS OF PRODUCTION AND USE THEREOF DDT, HLCS, BTD ESR1 1625/4885ESR2 3576/4885PDE10A 2168/4885

“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.