SCHEMBL6250022

SCHEMBL6250022

O=C1c2ccccc2CCC1(Cc1ccccc1)c1c[nH]cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SIGMAR1 Q99720 11/20 0.44
HTR2A P28223 10/20 0.44
HTR2C P28335 10/20 0.44
HTR2B P41595 10/20 0.44
DRD2 P14416 9/20 0.44
BACE1 P56817 1/20 0.41
CYP1A2 P05177 2/20 0.37
MAPT P10636 2/20 0.37
CYP2C19 P33261 2/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36

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
SCHEMBL8610413 0.74 NPSR1 (0.43) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL9431991 0.72 NPSR1 (0.40) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL6251528 0.69 SIGMAR1 (0.44) SIGMAR1HTR2AHTR2CHTR2BDRD2
SCHEMBL15700121 0.69 LMNA (0.54) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL8616201 0.67 KDM4E (0.39) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL6250064 0.65 LMNA (0.49) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL10925610 0.64 SIGMAR1 (0.43) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL15600621 0.63 NPSR1 (0.54) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL7937492 0.63 NPSR1 (0.54) LMNAHTTNPSR1L3MBTL1SIGMAR1
SCHEMBL7123284 0.63 NPSR1 (0.54) LMNAHTTNPSR1L3MBTL1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1280779-B1 NEW POLYCYCLIC INDANYLIMIDAZOLES WITH ALPHA2 ADRENERGIC ACTIVITY ORION CORP (FI) 2005-08-24 EP disclosed
EP-1280779-A1 NEW POLYCYCLIC INDANYLIMIDAZOLES WITH ALPHA2 ADRENERGIC ACTIVITY ORION CORPORATION (FI) 2003-02-05 EP disclosed
US-6362211-B2 FOR THERAPY OF NEUROLOGICAL, PSYCHIATRIC OR COGNITION DISORDER, DIABETES, LIPOLYTIC DISORDER, ORTHOSTATIC HYPOTENSION, OR SEXUAL DYSFUNCTION ORION CORPORATION (FI) 2002-03-26 US disclosed
US-20020013356-A1 New polycyclic indanylimidazoles with alpha2 adrenergic activity ORION CORPORATION (FI) 2002-01-31 US disclosed
WO-2001085698-A1 NEW POLYCYCLIC INDANYLIMIDAZOLES WITH ALPHA2 ADRENERGIC ACTIVITY ORION CORPORATION (FI) 2001-11-15 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-20020013356-A1 New polycyclic indanylimidazoles with alpha2 adrenergic activity ADRB2, ADRB1, ADRA1A LMNA 1844/4885HTT 4500/4885NPSR1 901/4885

“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.