SCHEMBL1120300

SCHEMBL1120300

O=C1N=CC=C2C1=Nc1ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 2/20 0.40
APAF1 O14727 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
TSHR P16473 1/20 0.40
HK1 P19367 1/20 0.40
GALK1 P51570 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
IDO1 P14902 1/20 0.38
SRC P12931 2/20 0.36
CTRB1 P17538 2/20 0.36
CCNE1 P24864 2/20 0.36
CDK2 P24941 2/20 0.36
AHR P35869 2/20 0.36

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
SCHEMBL29352286 1.00 MAPT (0.40) MAPTALDH1A1LMNAKMT2AMEN1
Trifluoroacetic Acid SCHEMBL6241485 0.87 MAPT (0.35) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL3226013 0.80 IDO1 (0.37) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL8905893 0.75 IDO1 (0.33) IDO1
SCHEMBL30168823 0.75 IDO1 (0.33) IDO1
SCHEMBL27840600 0.73 IDO1 (0.32) IDO1
SCHEMBL29941302 0.73 MEN1 (0.39) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL1506868 0.73 MAPT (0.39) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL29350249 0.73 MAPT (0.39) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL6573768 0.71 MEN1 (0.41) MAPTALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344379-A Diversity-oriented synthesis and activity research of alpha-carboline and beta-carboline-1-ketone derivatives 重庆医科大学 2024-07-16 CN claimed
CN-118344379-A Diversity-oriented synthesis and activity research of alpha-carboline and beta-carboline-1-ketone derivatives 重庆医科大学 2024-07-16 CN disclosed
US-11802129-B1 Pyrido[3,4-b]indol-1-one compounds as anticancer agents King Faisal University (SA) 2023-10-31 US disclosed
US-11802129-B1 Pyrido[3,4-b]indol-1-one compounds as anticancer agents King Faisal University (SA) 2023-10-31 US disclosed
US-11773092-B1 Pyrido[3,4-b]indol-1-one compounds as antibacterial agents King Faisal University (SA) 2023-10-03 US disclosed
EP-3538529-A1 SELECTIVE INHIBITORS OF GENOTOXIC STRESS-INDUCED IKK/NF-kB PATHWAYS Max-Delbrück-Centrum für Molekulare Medizin in der Helmholtz-Gemeinschaft (DE) 2019-09-18 EP disclosed
US-9988399-B2 Bicyclic compounds as ACC inhibitors and uses thereof GILEAD APOLLO, LLC (US) 2018-06-05 US disclosed
WO-2018087389-A1 SELECTIVE INHIBITORS OF GENOTOXIC STRESS-INDUCED IKK/NF-kB PATHWAYS MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN IN DER HELMHOLTZ-GEMEINSCHAFT (DE) 2018-05-17 WO disclosed
EP-2003129-B1 1H-Pyrido[3,4-B]indol-1-one and 2,3,4,9-Tetrahydro-1H-Beta-Carbolin-1-one Derivatives NERVIANO MEDICAL SCIENCES SRL (IT) 2017-08-09 EP disclosed
EP-2003129-B1 1H-Pyrido[3,4-B]indol-1-one and 2,3,4,9-Tetrahydro-1H-Beta-Carbolin-1-one Derivatives NERVIANO MEDICAL SCIENCES SRL (IT) 2017-08-09 EP disclosed
EP-2003129-A1 1H-Pyrido[3,4-B]indol-1-one and 2,3,4,9-Tetrahydro-1H-Beta-Carbolin-1-one Derivatives Nerviano Medical Sciences S.r.l. (IT) 2008-12-17 EP disclosed
WO-2008147864-A2 METHODS OF USING PIPERAZINE COMPOUNDS IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-12-04 WO disclosed
WO-2006061428-A2 GABA-A ALPHA 2 AND ALPHA 3 RECEPTOR AGONISTS FOR TREATING NEUROPATHIC, INFLAMMATORY AND MIGRAINE ASSOCIATED PAIN Universität Zürich (CH) 2006-06-15 WO disclosed
US-20050143371-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors PHARMACIA CORPORATION (US) 2005-06-30 US disclosed
US-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors PHARMACIA CORPORATION (US) 2005-06-23 US disclosed
WO-2005009370-A2 BETA-CARBOLINE COMPOUNDS AND ANALOGUES THEREOF AND THEIR USE AS MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 INHIBITORS PHARMACIA CORPORATION (US) 2005-02-03 WO disclosed
US-4837325-A Beta-carboline H1 -receptor antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 1989-06-06 US disclosed
US-4766124-A Beta-carbolin H1-receptor antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 1988-08-23 US disclosed
US-4663456-A 2-(substituted piperazinylalkyl)β-carbolines useful in treatment of psychological disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-05 US disclosed
US-4120963-A BLOOD DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1978-10-17 US 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 (4 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-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors MAPKAPK2, MAP4K2, MAP3K2 MAPT 1892/4885ALDH1A1 4386/4885LMNA 3942/4885
US-11773092-B1 Pyrido[3,4-b]indol-1-one compounds as antibacterial agents IDO1, IDO2, IMPA1 MAPT 1581/4885ALDH1A1 1039/4885LMNA 2926/4885
US-20050143371-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors MAP4K2, MAPKAPK2, MAP3K2 MAPT 2076/4885ALDH1A1 3919/4885LMNA 2064/4885
US-11802129-B1 Pyrido[3,4-b]indol-1-one compounds as anticancer agents IDO1, TYMP, AURKB MAPT 1042/4885ALDH1A1 1148/4885LMNA 1445/4885

“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.