SCHEMBL64117

SCHEMBL64117

C1CNCCN(C2CC2)C1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.56
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL3 Q96JM7 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
CXCR4 P61073 2/20 0.35
PDE7A Q13946 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
MBTD1 Q05BQ5 1/20 0.32

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
SCHEMBL2904654 1.00 HTR6 (0.56) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
Hydrochloric Acid SCHEMBL2973444 0.98 HTR6 (0.54) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL12469538 0.93 HTR6 (0.54) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL524430 0.93 HTR6 (0.59) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL1507120 0.93 HTR6 (0.65) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL6134512 0.91 HTR6 (0.63) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL9902700 0.91 HTR6 (0.63) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
Hydrochloric Acid SCHEMBL4321509 0.91 HTR6 (0.57) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
Hydrochloric Acid SCHEMBL450486 0.91 HTR6 (0.57) HTR6HPGDKMT2ASMN1; SMN2L3MBTL3
SCHEMBL894571 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP claimed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US claimed
US-20060189591-A1 Five-membered heterocyclic derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-08-24 US claimed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US claimed
EP-1621537-A1 FIVE-MEMBERED HETEROCYCLIC DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-02-01 EP claimed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP claimed
EP-4626871-A1 CD93 INHIBITORS Universität Bern (CH) 2025-10-08 EP disclosed
WO-2024115637-A1 CD93 INHIBITORS Universität Bern (CH) 2024-06-06 WO disclosed
EP-4378932-A1 NOVEL CD93 INHIBITORS Universität Bern (CH) 2024-06-05 EP disclosed
CN-114025847-B Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2024-05-24 CN disclosed
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2022-09-22 US disclosed
WO-2022140325-A1 6-SUBSTITUTED INDOLE COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-06-30 WO disclosed
US-11299487-B2 Compounds and compositions as modulators of TLR signaling NEUROPORE THERAPIES, INC. (US) 2022-04-12 US disclosed
US-20060189591-A1 Five-membered heterocyclic derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-08-24 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1621537-A1 FIVE-MEMBERED HETEROCYCLIC DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-02-01 EP disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP disclosed
US-4311616-A Method of preparing perfume compositions that contain tricyclo[5.2.1.02 ]decane carboxylic acid esters HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) HENKELSTRASSE 67, A CORP. OF GERMANY (DE) 1982-01-19 US disclosed
US-4191760-A ANTISCHIZOPHRENICS ABBOTT LABORATORIES (US) 1980-03-04 US disclosed
US-4096261-A ANTISCHIZOPHRENICS ABBOTT LABORATORIES (US) 1978-06-20 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-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 HTR6 1281/4885HPGD 18/4885KMT2A 4370/4885
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 HTR6 911/4885HPGD 2872/4885KMT2A 4366/4885
US-20060189591-A1 Five-membered heterocyclic derivative PTGS1, PTGIS, PTGS2 HTR6 1890/4885HPGD 19/4885KMT2A 4143/4885
US-11299487-B2 Compounds and compositions as modulators of TLR signaling TLR3, TLR6, TLR4 HTR6 529/4885HPGD 2978/4885KMT2A 3864/4885

“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.