SCHEMBL2801931

SCHEMBL2801931

c1coc(C2CCNCC2)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.41
HTR1A P08908 6/20 0.37
SLC6A2 P23975 6/20 0.37
SLC6A4 P31645 6/20 0.37
SLC6A3 Q01959 3/20 0.37
SLC18A3 Q16572 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
PLG P00747 2/20 0.35
USP7 Q93009 2/20 0.35
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
HRH4 Q9H3N8 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
SCHEMBL14683720 0.89 MPO (0.40) FAAHHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL5664401 0.85
SCHEMBL7032626 0.85 FAAH (0.31) FAAH
SCHEMBL9021546 0.81 CYP2C19 (0.37)
SCHEMBL16397376 0.81
SCHEMBL23901475 0.79
SCHEMBL8551055 0.79 CYP2C19 (0.40)
Hydrochloric Acid SCHEMBL9022156 0.79 CYP2C19 (0.36)
SCHEMBL10419433 0.79 CYP2C19 (0.40)
SCHEMBL16982375 0.79 CYP2C19 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4714446-A2 PHARMACEUTICAL COMPOUNDS Nxera Pharma UK Limited (GB) 2026-03-25 EP disclosed
EP-4626423-A1 CDK INHIBITORS AND METHODS AND USE THEREOF Relay Therapeutics, Inc. (US) 2025-10-08 EP disclosed
EP-4413985-A2 PHARMACEUTICAL COMPOUNDS Nxera Pharma UK Limited (GB) 2024-08-14 EP disclosed
WO-2024119122-A1 CDK INHIBITORS AND METHODS AND USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-06-06 WO disclosed
US-11566028-B2 Bicyclic heterocycles as FGFR inhibitors INCYTE CORPORATION (US) 2023-01-31 US disclosed
US-11566028-B2 Bicyclic heterocycles as FGFR inhibitors INCYTE CORPORATION (US) 2023-01-31 US disclosed
US-20210115053-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS INCYTE CORPORATION 2021-04-22 US disclosed
US-20210115053-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS INCYTE CORPORATION 2021-04-22 US disclosed
WO-2021076728-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS INCYTE CORPORATION (US) 2021-04-22 WO disclosed
WO-2021076728-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS INCYTE CORPORATION (US) 2021-04-22 WO disclosed
US-8642774-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-04 US disclosed
CN-101878217-B Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO LTD 2014-01-15 CN disclosed
US-20130150341-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 US disclosed
US-20130150341-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 US disclosed
CN-101878217-A Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO LTD 2010-11-03 CN disclosed
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-10-07 US disclosed
EP-2206714-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES Kyowa Hakko Kirin Co., Ltd. (JP) 2010-07-14 EP disclosed
EP-1232466-A2 METHOD FOR IDENTIFYING THE ACTIVE SITE IN A BIOLOGICAL TARGET Melacure Therapeutics AB (SE) 2002-08-21 EP disclosed
WO-2002006272-A1 POLYFLUOROALKYLTRIAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2002-01-24 WO disclosed
WO-2001036980-A2 A PROCESS FOR IDENTIFYING THE ACTIVE SITE IN A BIOLOGICAL TARGET MELACURE THERAPEUTICS AB (SE) 2001-05-25 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 (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-20210115053-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS FGFR1, FGFR3, FGFR2 FAAH 1605/4885HTR1A 3967/4885SLC6A2 4863/4885
US-20130150341-A1 NOVEL COMPOUNDS GRM5, GRM1, GRIK5 FAAH 649/4885HTR1A 113/4885SLC6A2 868/4885
US-11566028-B2 Bicyclic heterocycles as FGFR inhibitors FGFR1, FGFR3, FGFR2 FAAH 1605/4885HTR1A 3967/4885SLC6A2 4863/4885
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 FAAH 4583/4885HTR1A 4733/4885SLC6A2 1573/4885

“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.