SCHEMBL1273796

SCHEMBL1273796

O=C1CCCC(=O)N1n1cc2ccccc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.35
▸ HTT P42858 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ KMT2A Q03164 5/20 0.34
▸ PARL Q9H300 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CYP2A6 P11509 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ LMNA P02545 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TDP1 Q9NUW8 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
Hydrochloric Acid SCHEMBL30493329 0.98 ALDH1A1 (0.34) ALDH1A1HTTNOTUMKMT2APARL
Trifluoroacetic Acid SCHEMBL29148146 0.85 ALDH1A1 (0.35) ALDH1A1HTTKMT2AHSD17B10GAA
SCHEMBL31292622 0.73 POLB (0.43) ALDH1A1HTTKMT2APOLB
SCHEMBL6887988 0.70 KMT2A (0.36) ALDH1A1KMT2AMAPTHSD17B10LMNA
SCHEMBL29532110 0.69 NOTUM (0.39) ALDH1A1HTTNOTUMKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL30530520 0.68 NOTUM (0.38) ALDH1A1HTTNOTUMKMT2AL3MBTL1
SCHEMBL30600384 0.68 POLB (0.48) ALDH1A1HTTKMT2AMAPTHSD17B10
SCHEMBL3204064 0.68 POLB (0.48) ALDH1A1HTTKMT2AMAPTHSD17B10
SCHEMBL31491641 0.67 DDB1 (0.40) ALDH1A1NOTUMKMT2AMAPTHSD17B10
SCHEMBL5969633 0.67 MAOA (0.41) ALDH1A1HTTNOTUMKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4522621-A1 6,6A,7,8,9,10-HEXAHYDRO-5H-PYRAZINO[1',2':4,5]PYRAZINO[2,3-C]PYRIDAZINE DERIVATIVES AS SMARCA4 PROTEIN DEGRADERS FOR THE TREATMENT OF CANCER Prelude Therapeutics Incorporated (US) 2025-03-19 — — EP disclosed
EP-4466260-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2024-11-27 — — EP disclosed
EP-4351527-A1 NEW COMPOSITION COMPRISING IMMUNOMODULATORY DRUG Nanexa AB (SE) 2024-04-17 — — EP disclosed
EP-4334303-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE Nurix Therapeutics, Inc. (US) 2024-03-13 — — EP disclosed
CN-117229286-A Aromatic compound, preparation method thereof and application thereof in preparation of estrogen receptor degradation agent 海创药业股份有限公司 2023-12-15 — — CN disclosed
WO-2023220577-A1 6,6A,7,8,9,10-HEXAHYDRO-5H-PYRAZINO[1',2':4,5]PYRAZINO[2,3-C]PYRIDAZINE DERIVATIVES AS SMARCA4 PROTEIN DEGRADERS FOR THE TREATMENT OF CANCER PRELUDE THERAPEUTICS, INCORPORATED (US) 2023-11-16 — — WO disclosed
EP-4240743-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE Prelude Therapeutics, Incorporated (US) 2023-09-13 — — EP disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 — — WO disclosed
WO-2022258988-A1 NEW COMPOSITION COMPRISING IMMUNOMODULATORY DRUG NANEXA AB (SE) 2022-12-15 — — WO disclosed
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
WO-2022099117-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE PRELUDE THERAPEUTICS INCORPORATED (US) 2022-05-12 — — WO disclosed
EP-3784351-A1 CAR T CELL THERAPIES WITH ENHANCED EFFICACY Novartis AG (CH) 2021-03-03 — — EP disclosed
EP-3183244-A1 PROCESS FOR MAKING CRYSTALLINE FORM A OF LENALIDOMIDE Synthon BV (NL) 2017-06-28 — — EP disclosed
WO-2016026785-A1 PROCESS FOR MAKING CRYSTALLINE FORM A OF LENALIDOMIDE SYNTHON B.V. (NL) 2016-02-25 — — WO disclosed
WO-2011019636-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCERS AND PATHOGENIC INFECTIONS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2011-02-17 — — WO disclosed
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