SCHEMBL6249669

SCHEMBL6249669

CCOC(=O)CCC1(c2c[nH]cn2)Cc2ccccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 5/20 0.38
GAA P10253 3/20 0.38
LMNA P02545 3/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
MPI P34949 1/20 0.38
HTT P42858 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37

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
SCHEMBL9431991 0.84 NPSR1 (0.40) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL8610413 0.81 NPSR1 (0.43) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL9325639 0.72 OPRM1 (0.46) BRD4
SCHEMBL6250430 0.72 ALDH1A1 (0.44) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL8616201 0.70 KDM4E (0.39) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL1990722 0.67 BRD4 (0.45) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL7737588 0.66 ALDH1A1 (0.44) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL7639950 0.66 ADRA2A (0.37) KMT2AMAPTCYP1A2
SCHEMBL8611233 0.66 CYP19A1 (0.39)
SCHEMBL8614549 0.66 AKR1B1 (0.34) MAPTGABRA1GABRG2GABRB3GABRA5

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 MEN1 968/4885KMT2A 1443/4885ALDH1A1 116/4885

“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.