SCHEMBL6846925

SCHEMBL6846925

NC(=O)CCCOc1cccc(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
WDR5 P61964 1/20 0.57
PPARG P37231 3/20 0.53
PPARD Q03181 3/20 0.53
FFAR1 O14842 2/20 0.53
DRD2 P14416 1/20 0.53
DRD4 P21917 1/20 0.53
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KCNH2 Q12809 1/20 0.51
KMT2A Q03164 1/20 0.51
HRH3 Q9Y5N1 3/20 0.51
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL6849640 0.93 WDR5 (0.57) KDM4EWDR5PPARGPPARDFFAR1
SCHEMBL2914775 0.87 KDM4E (0.62) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL30025954 0.87 KDM4E (0.62) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL8389400 0.85 KDM4E (0.61) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL9205693 0.83 WDR5 (0.70) KDM4EWDR5PPARGPPARDFFAR1
SCHEMBL29818781 0.81 TAAR1 (0.50) SMN1; SMN2KMT2A
SCHEMBL2206953 0.81 TAAR1 (0.50) SMN1; SMN2KMT2A
SCHEMBL30025989 0.81 KDM4E (0.61) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL3728368 0.81 KDM4E (0.61) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL13348919 0.81 KDM4E (0.59) KDM4EPPARGPPARDFFAR1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6756384-B2 TREATMENT OF DISEASES AND DISORDERS RELATED TO THE HISTAMINE H3 RECEPTOR. NOVO NORDISK A/S (DK) 2004-06-29 US disclosed
US-20030135056-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2003-07-17 US disclosed
EP-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
US-6437147-B1 FOR THERAPY OF DISEASES OF CENTRAL NERVOUS SYSTEM, PERIPHERAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM, PULMONARY SYSTEM, GASTROINTESTINAL SYSTEM AND ENDOCRINOLOGICAL SYSTEM NOVO NORDISK (DK) 2002-08-20 US disclosed
US-20020058659-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2002-05-16 US disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 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-20030135056-A1 Imidazole compounds HRH3, HRH4, HRH2 KDM4E 2142/4885WDR5 1218/4885PPARG 1231/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 KDM4E 2142/4885WDR5 1218/4885PPARG 1231/4885

“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.