SCHEMBL295559

SCHEMBL295559

O=C1COc2cc(O)ccc2N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.56
CREBBP Q92793 1/20 0.56
MMP12 P39900 1/20 0.51
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
PARP1 P09874 1/20 0.47
KIF11 P52732 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
DRD2 P14416 3/20 0.46
DRD4 P21917 3/20 0.46
DRD3 P35462 3/20 0.46
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PKM P14618 1/20 0.44

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
SCHEMBL29754331 0.86 MMP12 (0.65) MMP12PARP1ALDH1A1MAPTKMT2A
SCHEMBL861110 0.86 MMP12 (0.65) MMP12PARP1ALDH1A1MAPTKMT2A
SCHEMBL6295833 0.83 PDE3B (0.45) BRD4CREBBPMMP12CYP11B1CYP11B2
SCHEMBL6296965 0.83 CYP11B1 (0.44) BRD4CREBBPMMP12CYP11B1CYP11B2
SCHEMBL6297431 0.83 KIF11 (0.62) MMP12CYP11B1CYP11B2KIF11ALDH1A1
SCHEMBL15964758 0.83 MAOA (0.54) BRD4CREBBPMMP12CYP11B1CYP11B2
SCHEMBL26604998 0.82 MMP12 (0.56) MMP12PARP1ALDH1A1MAPTKMT2A
SCHEMBL1861248 0.79 NR3C2 (0.57) MMP12CYP11B1CYP11B2PARP1KIF11
SCHEMBL304249 0.79 DRD4 (0.56) MMP12CYP11B1CYP11B2PARP1KIF11
SCHEMBL276741 0.79 MMP12 (0.51) MMP12CYP11B1CYP11B2PARP1KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174634-A1 Aldehyde Dehydrogenase Inhibitors and Their Therapeutic Use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-05-30 US disclosed
CN-109988093-B Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine 广东东阳光药业有限公司 2023-04-07 CN disclosed
CN-112442013-B Compound serving as thyroid hormone beta receptor agonist and application thereof 广东东阳光药业有限公司 2022-07-26 CN disclosed
WO-2022123039-A1 ALDEHYDE DEHYDROGENASE INHIBITORS AND THEIR THERAPEUTIC USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-06-16 WO disclosed
EP-3831383-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2021-06-09 EP disclosed
WO-2021043185-A1 A COMPOUND AS A THYROID HORMONE BETA RECEPTOR AGONIST AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-03-11 WO disclosed
EP-3283077-B1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RES INC (US) 2021-03-10 EP disclosed
US-10807982-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-10-20 US disclosed
US-20200071332-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-05 US disclosed
US-10428030-B2 Heterocycle derivatives and their use for the treatment of CNS disorders Trillium Therapeutics (CA) 2019-10-01 US disclosed
US-20060058361-A1 Therapeutic diphenyl ether ligands PFIZER INC 2006-03-16 US disclosed
WO-2005070891-A2 COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2005-08-04 WO disclosed
US-20040224948-A1 Novel substituted benzoxazines as integrin antagonists PHARMACIA & UPJOHN S.P.A. (IT) 2004-11-11 US disclosed
US-6750215-B2 ANTITUMOR AGENTS; ANTICANCER AGENTS PHARMACIA & UPJOHN, S.P.A. (IT) 2004-06-15 US disclosed
US-20030073688-A1 Novel substituted benzoxazines as integrin antagonists POLSTER, RACHEL A. 2003-04-17 US disclosed
EP-0237781-B1 PHENYL AND HETEROCYCLIC TETRAHYDROPYRIDYL AND PIPERAZINYL ALKOXY-BENZHETEROCYCLIC COMPOUNDS AS ANTIPSYCHOTIC AGENTS WARNER-LAMBERT COMPANY (US) 1991-04-24 EP disclosed
US-4803203-A SCHIZOPHRENIA, NEUOLEPTIC AGENTS WARNER-LAMBERT COMPANY (US) 1989-02-07 US disclosed
US-4704390-A SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 1987-11-03 US disclosed
EP-0237781-A2 Phenyl and heterocyclic tetrahydropyridyl and piperazinyl alkoxy-benzheterocyclic compounds as antipsychotic agents WARNER-LAMBERT COMPANY (US) 1987-09-23 EP disclosed
EP-0171702-A1 Benzoxazinone derivatives, preparation and use BEECHAM GROUP PLC (GB) 1986-02-19 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 (7 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-20200071332-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 BRD4 5/4885CREBBP 45/4885MMP12 1635/4885
US-20040224948-A1 Novel substituted benzoxazines as integrin antagonists ITGB1, ITGA1, ITGB3 BRD4 840/4885CREBBP 3060/4885MMP12 672/4885
US-10807982-B2 Bromodomain inhibitors BRD3, EP300, BRPF3 BRD4 5/4885CREBBP 45/4885MMP12 1635/4885
US-10428030-B2 Heterocycle derivatives and their use for the treatment of CNS disorders GRIN2C, ACHE, CNR1 BRD4 1026/4885CREBBP 125/4885MMP12 2029/4885
US-20030073688-A1 Novel substituted benzoxazines as integrin antagonists ITGB1, ITGA1, ITGB3 BRD4 840/4885CREBBP 3060/4885MMP12 672/4885
US-20240174634-A1 Aldehyde Dehydrogenase Inhibitors and Their Therapeutic Use ALDH2, ALDH1A1, ALDH3A1 BRD4 791/4885CREBBP 606/4885MMP12 620/4885
US-20060058361-A1 Therapeutic diphenyl ether ligands HTR2B, HTR2C, HTR3B BRD4 3759/4885CREBBP 2490/4885MMP12 732/4885

“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.