SCHEMBL1636847

SCHEMBL1636847

COc1cccc(C2CNCCN2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.56
EED O75530 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTR2A P28223 2/20 0.43
HTR2B P41595 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
PDE10A Q9Y233 3/20 0.43
HTR7 P34969 1/20 0.43
ADRB1 P08588 1/20 0.43
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43

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
SCHEMBL1637555 1.00 HTR2C (0.56) HTR2CEEDMEN1KMT2AHTR2A
SCHEMBL1637389 1.00 HTR2C (0.56) HTR2CEEDMEN1KMT2AHTR2A
SCHEMBL12536768 0.84 HTR2C (0.60) HTR2CEEDMEN1KMT2AKDM4E
SCHEMBL3957254 0.83 ADRB1 (0.40) HTR2CEEDMEN1KMT2AHTR2A
SCHEMBL1639240 0.83 ADRB1 (0.40) HTR2CEEDMEN1KMT2AHTR2A
SCHEMBL1638815 0.83 MAOA (0.43) HTR2CMEN1KMT2AHTR2AHTR2B
SCHEMBL5562690 0.80 MAOA (0.53) HTR2CMEN1KMT2AHTR2AHTR2B
SCHEMBL1639545 0.80 MAOA (0.53) HTR2CMEN1KMT2AHTR2AHTR2B
SCHEMBL6178879 0.79 MEN1 (0.61) HTR2CEEDMEN1KMT2AHTR2A
SCHEMBL2808985 0.79 MEN1 (0.61) HTR2CEEDMEN1KMT2AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117164807-A Polyurethane-polyurea water dispersion and preparation method thereof 万华化学集团股份有限公司 2023-12-05 CN claimed
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US claimed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP claimed
CN-104046246-A Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PROD & CHEM 2014-09-17 CN claimed
US-20240052090-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ARKEMA FRANCE (FR) 2024-02-15 US disclosed
CN-117279972-A Two-component polyurethane compositions, methods of making, and methods of using the same 阿科玛法国 2023-12-22 CN disclosed
CN-117164807-A Polyurethane-polyurea water dispersion and preparation method thereof 万华化学集团股份有限公司 2023-12-05 CN disclosed
EP-4263209-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ARKEMA FRANCE (FR) 2023-10-25 EP disclosed
US-11414764-B2 Method of inhibiting metal corrosion with a piperazine-based polyurea KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-08-16 US disclosed
WO-2022133025-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ASHLAND LICENSING AND INTELLECTUAL PROPERTY LLC (US) 2022-06-23 WO disclosed
US-20210115570-A1 METHOD OF INHIBITING METAL CORROSION WITH A PIPERAZINE-BASED POLYUREA KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2021-04-22 US disclosed
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US disclosed
US-20080076924-A1 Piperazines as P2X7 antagonists ABBOTT LABORATORIES 2008-03-27 US disclosed
US-20080076924-A1 Piperazines as P2X7 antagonists ABBOTT LABORATORIES 2008-03-27 US disclosed
WO-2008006372-A1 (3-ARYL-PIPERAZIN-1-YL), (2-ARYL-MORPHOLIN-4-YL) AND (2-ARYL- THIOMORPHOLIN-4-YL) DERIVATIVES OF 6,7-DIALKOXYQUINAZOLINE, 6,7- DIALKOXYPHTALAZINE AND 6,7-DIALKOXYISOQUINOLINE H. LUNDBECK A/S (DK) 2008-01-17 WO disclosed
EP-1492794-B1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS LILLY CO ELI (US) 2007-12-12 EP disclosed
US-7214673-B2 For therapy of psychosis and bipolar disorder ELI LILLY AND COMPANY (US) 2007-05-08 US disclosed
US-20050203296-A1 For therapy of psychosis and bipolar disorder ELI LILLY AND COMPANY 2005-09-15 US disclosed
EP-1492794-A1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS ELI LILLY AND COMPANY (US) 2005-01-05 EP disclosed
WO-2003082877-A1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS ELI LILLY AND COMPANY (US) 2003-10-09 WO 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 (2 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-20050203296-A1 For therapy of psychosis and bipolar disorder DRD4, AFF4, DRD2 HTR2C 137/4885EED 1421/4885MEN1 4508/4885
US-20080076924-A1 Piperazines as P2X7 antagonists P2RX7, P2RX1, P2RX2 HTR2C 232/4885EED 4592/4885MEN1 4288/4885

“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.