SCHEMBL7204153

SCHEMBL7204153

c1c2c(cc3c1OCCO3)OCCC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
CTNNB1 P35222 6/20 0.39
WNT3A P56704 6/20 0.39
HTR1D P28221 1/20 0.39
HTR2C P28335 1/20 0.39
NOTUM Q6P988 1/20 0.38
MTNR1A P48039 2/20 0.38
PRKCI P41743 1/20 0.37
RIPK1 Q13546 1/20 0.35
MTNR1B P49286 1/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
BLM P54132 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
SCHEMBL31452888 0.86 CLK1 (0.40) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL14405286 0.77 CTNNB1 (0.41) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL30762291 0.77 CTNNB1 (0.41) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL29141427 0.77 CTNNB1 (0.41) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL18946020 0.77 CTNNB1 (0.41) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL12333251 0.77 ADCY6 (0.42) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL984492 0.76 PRKCI (0.48) DYRK1ADYRK1BPRKCISMN1; SMN2MAPT
SCHEMBL7082445 0.76 DRD2 (0.45) CLK1DYRK1ADYRK1BMTNR1APRKCI
SCHEMBL15290407 0.76 DRD2 (0.45) CLK1DYRK1ADYRK1BMTNR1APRKCI
SCHEMBL27382541 0.76 ITGB2 (0.53) ITGB2ICAM1ITGALLMNASMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1139584-C Heterocyclic compounds, method for preparing and medicine compositions containing same ɪά��ʵ���� 2004-02-25 CN claimed
US-6602903-B2 Substituted O- and/or S heterocyclic compounds; powerful ligands for melatoninergic receptors. LES LABORATORIES SERVIER (FR) 2003-08-05 US claimed
US-20020052400-A1 Substituted heterocyclic compounds ADIR ET COMPAGNIE 2002-05-02 US claimed
CN-1260789-A Heterocyclic compounds, method for preparing and medicine compositions containing same ADIR CO (FR) 2000-07-19 CN claimed
CN-1139584-C Heterocyclic compounds, method for preparing and medicine compositions containing same ɪά��ʵ���� 2004-02-25 CN disclosed
US-6602903-B2 Substituted O- and/or S heterocyclic compounds; powerful ligands for melatoninergic receptors. LES LABORATORIES SERVIER (FR) 2003-08-05 US disclosed
US-20020052400-A1 Substituted heterocyclic compounds ADIR ET COMPAGNIE 2002-05-02 US disclosed
US-6313160-B1 FOR THERAPY AND PROPHYLAXIS OF MELATONINERGIC DISORDERS ADIR ET COMPAGNIE (FR) 2001-11-06 US disclosed
CN-1260789-A Heterocyclic compounds, method for preparing and medicine compositions containing same ADIR CO (FR) 2000-07-19 CN disclosed
EP-0998471-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME ADIR ET COMPAGNIE (FR) 2000-05-10 EP disclosed
WO-1998052935-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME ADIR ET COMPAGNIE (FR) 1998-11-26 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 (1 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-20020052400-A1 Substituted heterocyclic compounds MTNR1A, MTNR1B, CBR1 CLK1 4634/4885DYRK1A 3679/4885DYRK1B 3924/4885

“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.