SCHEMBL6850933

SCHEMBL6850933

CNCCCCCOc1ccccc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.85
L3MBTL1 Q9Y468 4/20 0.74
HTR1D P28221 1/20 0.74
KCNA3 P22001 1/20 0.64
DRD2 P14416 4/20 0.57
DRD4 P21917 4/20 0.57
DRD3 P35462 4/20 0.57
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
TP53 P04637 1/20 0.56
CYP1A2 P05177 1/20 0.56

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
SCHEMBL6849557 0.98 HTR1B (0.88) HTR1BL3MBTL1HTR1DKCNA3DRD2
SCHEMBL1109801 0.92 HTR1B (1.00) HTR1BL3MBTL1HTR1DKCNA3DRD2
SCHEMBL10675449 0.89 L3MBTL1 (0.71) HTR1BL3MBTL1HTR1DKCNA3HDAC3
SCHEMBL7370368 0.86 L3MBTL1 (0.77) HTR1BL3MBTL1HTR1DTP53CYP1A2
SCHEMBL595753 0.85 HTR1B (1.00) HTR1BL3MBTL1HTR1DKCNA3DRD2
Hydrochloric Acid SCHEMBL7372065 0.85 L3MBTL1 (0.74) HTR1BL3MBTL1HTR1DTP53CYP1A2
SCHEMBL13886634 0.85 HTR1B (0.85) HTR1BL3MBTL1HTR1DKCNA3DRD2
SCHEMBL11894925 0.83 DRD2 (0.80) HTR1BKCNA3DRD2DRD4DRD3
Iodide SCHEMBL30481083 0.83 HTR1B (0.96) HTR1BL3MBTL1HTR1DKCNA3DRD2
Hydrochloric Acid SCHEMBL10921722 0.83 HTR1B (0.96) HTR1BL3MBTL1HTR1DKCNA3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9000107-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2015-04-07 US claimed
US-9000107-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2015-04-07 US disclosed
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 HTR1B 114/4885L3MBTL1 3041/4885HTR1D 146/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 HTR1B 114/4885L3MBTL1 3041/4885HTR1D 146/4885

“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.