SCHEMBL2017633

SCHEMBL2017633

ClCCOC(c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.57
ADRA2A P08913 4/20 0.57
CHRM1 P11229 4/20 0.57
SLC6A2 P23975 4/20 0.57
SLC6A4 P31645 4/20 0.57
OPRM1 P35372 4/20 0.57
DRD3 P35462 4/20 0.57
SLC6A3 Q01959 4/20 0.57
SCN1A P35498 3/20 0.57
SCN2A Q99250 3/20 0.57
SCN3A Q9NY46 3/20 0.57
CYP2D6 P10635 3/20 0.57
ADRA1A P35348 3/20 0.57
KCNH2 Q12809 3/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 2/20 0.57
CYP1A2 P05177 2/20 0.57
TSHR P16473 2/20 0.57
CHRM4 P08173 2/20 0.57
CHRM5 P08912 2/20 0.57

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
SCHEMBL9242920 0.90 CYP3A4 (0.59) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL9239838 0.89 SCN1A (0.51) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL10549358 0.89 SLC6A3 (0.52) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL10356352 0.87 SCN1A (0.53) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL27315712 0.86 SCN1A (0.45) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL4667564 0.85 SCN1A (0.65) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL6983440 0.85 SCN1A (0.52) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL21861456 0.84 SCN1A (0.50) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL6981112 0.84 SCN1A (0.50) CHRM2ADRA2ACHRM1SLC6A2SLC6A4
SCHEMBL6978977 0.84 SCN1A (0.50) CHRM2ADRA2ACHRM1SLC6A2SLC6A4

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
US-20210401998-A1 METHODS OF TREATING CYP2D6 ALTERNATIVE METABOLIZERS NEKTAR THERAPEUTICS (US) 2021-12-30 US disclosed
US-11033631-B2 Methods of treating CYP2D6 alternative metabolizers NEKTAR THERAPEUTICS (US) 2021-06-15 US disclosed
US-20150174264-A1 Oligomer-Antihistamine Conjugates NEKTAR THERAPEUTICS (US) 2015-06-25 US disclosed
US-20150174264-A1 Oligomer-Antihistamine Conjugates NEKTAR THERAPEUTICS (US) 2015-06-25 US disclosed
US-20150174264-A1 Oligomer-Antihistamine Conjugates NEKTAR THERAPEUTICS (US) 2015-06-25 US disclosed
EP-2121031-B1 OLIGOMER-ANTIHISTAMINE CONJUGATES NEKTAR THERAPEUTICS (US) 2013-10-16 EP disclosed
EP-2121031-B1 OLIGOMER-ANTIHISTAMINE CONJUGATES NEKTAR THERAPEUTICS (US) 2013-10-16 EP disclosed
US-20130053400-A1 OLIGOMER-ANTIHISTAMINE CONJUGATES NEKTAR THERAPEUTICS (US) 2013-02-28 US disclosed
US-20130053400-A1 OLIGOMER-ANTIHISTAMINE CONJUGATES NEKTAR THERAPEUTICS (US) 2013-02-28 US disclosed
US-20130053400-A1 OLIGOMER-ANTIHISTAMINE CONJUGATES NEKTAR THERAPEUTICS (US) 2013-02-28 US disclosed
EP-0157420-A2 Amide derivatives and 5-lipoxygenase inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-10-09 EP disclosed
US-4521537-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1985-06-04 US disclosed
EP-0111955-A1 Prostaglandin intermediates NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1984-06-27 EP disclosed
WO-1982000142-A1 PROSTAGLANDINS JONES R 1982-01-21 WO disclosed
EP-0043292-A2 Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1982-01-06 EP disclosed
US-4265894-A TREATING PARKINSON'S DISEASE AND ACROMEGALY GIST BROCADES, N.V. (NL) 1981-05-05 US disclosed
US-4202896-A DOPAMINERGIC ACTIVITY GIST-BROCADES N.V. (NL) 1980-05-13 US disclosed
US-3993768-A FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1976-11-23 US disclosed
US-3985889-A 1,3-DIHYDROSPIRO(ISOBENZOFURAN); ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-10-12 US disclosed
US-3962259-A TRANQUILIZERS, ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-06-08 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 (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-20150174264-A1 Oligomer-Antihistamine Conjugates HRH4, HRH1, HRH3 CHRM2 178/4885ADRA2A 289/4885CHRM1 172/4885
US-20130053400-A1 OLIGOMER-ANTIHISTAMINE CONJUGATES HRH4, HRH1, HRH3 CHRM2 181/4885ADRA2A 262/4885CHRM1 169/4885

“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.