SCHEMBL3134286

SCHEMBL3134286

O=c1[nH]cnn2cncc12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
ACVR1 Q04771 1/20 0.31
KDM4A O75164 1/20 0.31
KDM4B O94953 1/20 0.31
KDM5C P41229 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
KDM3A Q9Y4C1 1/20 0.31

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
SCHEMBL170132 0.72 ACVR1 (0.43) ACVR1KDM4AKDM4BKDM5CKDM5B
SCHEMBL4948959 0.70
SCHEMBL4052150 0.65 NR1H2 (0.36) ALDH1A1ACVR1
SCHEMBL12406064 0.65 PARP1 (0.35) ALDH1A1ACVR1
SCHEMBL21199524 0.65 PARP1 (0.35)
SCHEMBL12102064 0.65 TNKS2 (0.36)
Hydrochloric Acid SCHEMBL17868497 0.64 PARP1 (0.34) ALDH1A1
SCHEMBL13218216 0.63 ALDH1A1 (0.36) ALDH1A1KDM4AKDM4BKDM5CKDM4C
SCHEMBL16663842 0.62 ACVR1 (0.51) ACVR1KDM5B
SCHEMBL18956248 0.62 NR1H2 (0.36) ALDH1A1

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
EP-2807163-A1 PDE9 INHIBITORS WITH IMIDAZO TRIAZINONE BACKBONE H. Lundbeck A/S (DK) 2014-12-03 EP claimed
WO-2013110768-A1 PDE9 INHIBITORS WITH IMIDAZO TRIAZINONE BACKBONE H. LUNDBECK A/S (DK) 2013-08-01 WO claimed
US-20260001885-A1 4-IMIDAZOPYRIDAZIN-1-YL-BENZAMIDES AS BTK INHIBITORS MERCK SHARP & DOHME (NL) 2026-01-01 US disclosed
US-20250360137-A1 ENHANCEMENT OF THE EFFICACY OF SEROTONERGIC PSYCHEDELIC DRUGS IN THE TREATMENT OR PREVENTION OF CERTAIN NEUROPSYCHIATRIC DISORDERS THROUGH INHIBITION OF TYPE-9 PHOSPHODIESTERASES FREEDOM BIOSCIENCES INC (US) 2025-11-27 US disclosed
US-20250276983-A1 COMPOUNDS AND METHODS FOR MODULATING HER2 IAMBIC THERAPEUTICS, INC. 2025-09-04 US disclosed
EP-4577549-A1 COMPOUNDS AND METHODS FOR MODULATING HER2 Iambic Therapeutics, Inc. (US) 2025-07-02 EP disclosed
US-12162890-B2 Heteroaromatic NMDA receptor modulators and uses thereof NOVARTIS AG (CH) 2024-12-10 US disclosed
US-12152051-B2 Cyclic dinucleotide analogue, pharmaceutical composition thereof, and application Shanghai De Novo Pharmatech Co., Ltd. (CN) 2024-11-26 US disclosed
US-12145948-B2 Compounds and methods for modulating HER2 IAMBIC THERAPEUTICS, INC. (US) 2024-11-19 US disclosed
EP-3854799-B1 CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2024-07-17 EP disclosed
EP-3854799-B1 CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2024-07-17 EP disclosed
WO-2008117169-A1 PYRIMIDO [4, 5-D] AZEPINE DERIVATIVES AS 5-HT2C AGONISTS PFIZER LIMITED (GB) 2008-10-02 WO disclosed
US-20080167462-A1 2-substituted phenyl-5, 7-dehydrocarbyl-3, 7-dihydropyrrolo [2, 3-d] pyrimidin-4-one derivatives, the preparation and the pharmaceutical use thereof TIANJIN TASLY GROUP CO., LTD (CN) 2008-07-10 US disclosed
US-20060264624-A1 Methods for synthesizing imidazotriazinones LEXICON GENETICS INCORPORATED 2006-11-23 US disclosed
US-20060173025-A1 2-Substituted phenyl-5,7-dialkyl-3,7-dihydropyrrole [2,3-d]pyrimidine-4-one derivatives, the preparation and the pharmaceutical use thereof YANGTZE RIVER PHARMACEUTICAL (GROUP) CO., LTD. (CN) 2006-08-03 US disclosed
EP-1634883-A1 2-SUBSTITUTED PHENYL-5,7-DIALKYL-3,7-DIHYDROPYRROLE[2,3-D]PYRIMIDINE-4-ONE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF Tianjin Tasly Group Co., Ltd. (CN) 2006-03-15 EP disclosed
EP-1392314-A1 NOVEL USE OF 2-PHENYL-SUBSTITUTED IMIDAZOTRIAZINONES Bayer HealthCare AG (DE) 2004-03-03 EP disclosed
WO-2002089808-A1 NOVEL USE OF 2-PHENYL-SUBSTITUTED IMIDAZOTRIAZINONES BAYER HEALTHCARE AG (DE) 2002-11-14 WO disclosed
US-4308384-A Production of triazinones GLAXO GROUP LIMITED (GB) 1981-12-29 US disclosed
EP-0009384-A1 Processes for the preparation of triazinones and condensed triazinones, and compounds so obtained GLAXO GROUP LIMITED (GB) 1980-04-02 EP 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-20080167462-A1 2-substituted phenyl-5, 7-dehydrocarbyl-3, 7-dihydropyrrolo [2, 3-d] pyrimidin-4-one derivatives, the preparation and the pharmaceutical use thereof PDE5A, PDE3B, PDE2A ALDH1A1 681/4885ACVR1 2903/4885KDM4A 2303/4885
US-12162890-B2 Heteroaromatic NMDA receptor modulators and uses thereof GRIN2C, GRIN2A, GRIN1 ALDH1A1 1771/4885ACVR1 3993/4885KDM4A 2100/4885
US-20060173025-A1 2-Substituted phenyl-5,7-dialkyl-3,7-dihydropyrrole [2,3-d]pyrimidine-4-one derivatives, the preparation and the pharmaceutical use thereof PDE5A, PDE3B, PDE2A ALDH1A1 1203/4885ACVR1 2865/4885KDM4A 2103/4885
US-20250360137-A1 ENHANCEMENT OF THE EFFICACY OF SEROTONERGIC PSYCHEDELIC DRUGS IN THE TREATMENT OR PREVENTION OF CERTAIN NEUROPSYCHIATRIC DISORDERS THROUGH INHIBITION OF TYPE-9 PHOSPHODIESTERASES PDE9A, PDE3A, PDE2A ALDH1A1 1406/4885ACVR1 3984/4885KDM4A 1035/4885
US-12145948-B2 Compounds and methods for modulating HER2 ERBB2, EGFR, ERBB3 ALDH1A1 2783/4885ACVR1 2502/4885KDM4A 3289/4885
US-12152051-B2 Cyclic dinucleotide analogue, pharmaceutical composition thereof, and application STING1, CGAS, IRF3 ALDH1A1 4772/4885ACVR1 1890/4885KDM4A 3989/4885
US-20260001885-A1 4-IMIDAZOPYRIDAZIN-1-YL-BENZAMIDES AS BTK INHIBITORS BTK, ABL1, FLT3 ALDH1A1 4166/4885ACVR1 4661/4885KDM4A 982/4885
US-20250276983-A1 COMPOUNDS AND METHODS FOR MODULATING HER2 ERBB2, EGFR, ERBB3 ALDH1A1 2783/4885ACVR1 2502/4885KDM4A 3289/4885
US-20060264624-A1 Methods for synthesizing imidazotriazinones PDE3A, PDE2A, PDE3B ALDH1A1 1422/4885ACVR1 1238/4885KDM4A 270/4885

“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.