SCHEMBL6846924

SCHEMBL6846924

O=CNCCCOc1cccc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.68
DRD4 P21917 2/20 0.68
KMT2A Q03164 1/20 0.66
KDM4E B2RXH2 2/20 0.50
KCNH2 Q12809 1/20 0.50
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
DRD3 P35462 1/20 0.47
HRH3 Q9Y5N1 3/20 0.47
HTR1A P08908 2/20 0.47
FFAR1 O14842 1/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46

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
SCHEMBL19513498 0.95 DRD2 (0.65) DRD2DRD4KMT2AKDM4EKCNH2
SCHEMBL5072991 0.81 DRD4 (0.60) DRD2DRD4KMT2AKCNH2DRD3
SCHEMBL97532 0.81 DRD2 (0.55) DRD2DRD4KMT2AKDM4EKCNH2
SCHEMBL6673798 0.81 DRD4 (0.66) DRD2DRD4DRD3
SCHEMBL6846928 0.80 KMT2A (0.69) DRD2DRD4KMT2AKDM4EKCNH2
Hydrochloric Acid SCHEMBL6851368 0.80 DRD4 (0.58) DRD2DRD4KMT2AKCNH2LMNA
Hydrochloric Acid SCHEMBL8060178 0.79 DRD4 (0.97) DRD2DRD4KMT2ADRD3
SCHEMBL9808215 0.78 LMNA (0.67) DRD2DRD4KMT2AKDM4EKCNH2
SCHEMBL17163970 0.78 DRD2 (0.64) DRD2DRD4KMT2AKDM4EHRH3
SCHEMBL7059928 0.78 KMT2A (0.67) DRD2DRD4KMT2AKDM4EKCNH2

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 DRD2 668/4885DRD4 1390/4885KMT2A 300/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 DRD2 668/4885DRD4 1390/4885KMT2A 300/4885

“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.