SCHEMBL6448475

SCHEMBL6448475

CC1COCc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
CHRNA7 P36544 1/20 0.38
ACHE P22303 1/20 0.34
NOTUM Q6P988 1/20 0.34
OPRM1 P35372 2/20 0.33
PDPK1 O15530 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL15145778 1.00 HTR2A (0.43) HTR2AHTR2CHTR2BALDH1A1MAPT
SCHEMBL2600798 0.78 HTR2A (0.37) HTR2AHTR2CHTR2BALDH1A1MAPT
SCHEMBL25180633 0.75 HTR2A (0.34) HTR2AHTR2CNOTUMSLC6A2SLC6A4
SCHEMBL30386978 0.75 MAOA (0.39) HTR2ANOTUM
SCHEMBL30387994 0.75 HTR2A (0.34) HTR2AHTR2CNOTUMSLC6A2SLC6A4
SCHEMBL23505819 0.75 HTR2A (0.34) HTR2AHTR2CNOTUM
SCHEMBL3554635 0.75 HTR2A (0.34) HTR2AHTR2CNOTUMSLC6A2SLC6A4
SCHEMBL19829945 0.75 HTR2A (0.43) HTR2AHTR2CNOTUM
SCHEMBL3167798 0.75 MAOA (0.39) HTR2ANOTUM
SCHEMBL19829938 0.75 HTR2A (0.43) HTR2AHTR2CNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1089963-B1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF THE PRODUCTION OF HUMAN CD23 AND OF THE TNF RELEASE SMITHKLINE BEECHAM PLC (GB) 2004-06-16 EP claimed
US-6458779-B1 TREATMENT OF CONDITIONS ASSOCIATED WITH EXCESS PRODUCTION OF SOLUBLE CD23 (S-CD23) SUCH AS AUTOIMMUNE DISEASE AND ALLERGY. THE COMPOUNDS OF THE INVENTION ARE ALSO INHIBITORS OF THE RELEASE OF TUMOUR NECROSIS FACTOR (TNF). SMITHKLINE BEECHAM P.L.C. (GB) 2002-10-01 US claimed
WO-2023192375-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. (US) 2023-10-05 WO disclosed
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-08 US disclosed
US-20230149414-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-18 US disclosed
US-20230141809-A1 QUINOLINE DERIVATIVES ELANCO ANIMAL HEALTH GMBH (DE) 2023-05-11 US disclosed
WO-2022260441-A1 PREPARATION OF SUBSTITUTED 1,2-DIAMINOHETEROCYCLIC COMPOUND DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS AVELOS THERAPEUTICS INC. (KR) 2022-12-15 WO disclosed
WO-2021242844-A1 GRK2 INHIBITORS AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2021-12-02 WO disclosed
US-11077090-B2 Compounds and compositions and uses thereof SUNOVION PHARMACEUTICALS INC. (MA) 2021-08-03 US disclosed
WO-2018023070-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF SUNOVION PHARMACEUTICALS, INC. (US) 2018-02-01 WO disclosed
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF PGI DRUG DISCOVERY LLC 2018-02-01 US disclosed
WO-2008011392-A2 PROLINE UREA CCR1 ANTAGONISTS FOR THE TREATMENT OF AUTOIMMUNE DISEASES OR INFLAMMATION LIGAND PHARMACUETICALS INCORPORATED (US) 2008-01-24 WO disclosed
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 EP disclosed
EP-0179377-B1 PROCESS FOR THE PREPARATION OF 1-ALKOXYISOCHROMANES, AND 1-ALKOXY ALKYLISOCHROMANES BASF Aktiengesellschaft (DE) 1988-01-20 EP disclosed
EP-0179377-A1 Process for the preparation of 1-alkoxyisochromanes, and 1-alkoxy alkylisochromanes BASF Aktiengesellschaft (DE) 1986-04-30 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 (6 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-20230149414-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB HTR2A 3273/4885HTR2C 3674/4885HTR2B 3072/4885
US-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 HTR2A 1261/4885HTR2C 2656/4885HTR2B 1124/4885
US-11077090-B2 Compounds and compositions and uses thereof ACHE, CHAT, MAOB HTR2A 199/4885HTR2C 196/4885HTR2B 146/4885
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF ACHE, CHAT, MAOB HTR2A 199/4885HTR2C 196/4885HTR2B 146/4885
US-20230141809-A1 QUINOLINE DERIVATIVES RECQL, NQO2, QTRT2 HTR2A 1252/4885HTR2C 852/4885HTR2B 1050/4885
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS H1-5, H1-10, H1-0 HTR2A 827/4885HTR2C 1437/4885HTR2B 1546/4885

“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.