SCHEMBL2933100

SCHEMBL2933100

CCOC(=O)Cc1c(-c2ccccc2)nc2ccc(Cl)cn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A2 P11168 1/20 0.86
GABRA2 P47869 1/20 0.70
GABRB2 P47870 1/20 0.70
CYP1A2 P05177 2/20 0.69
CYP2C9 P11712 2/20 0.69
CYP2C19 P33261 2/20 0.69
ALDH1A1 P00352 1/20 0.69
GAA P10253 1/20 0.69
CYP2D6 P10635 1/20 0.69
HPGD P15428 1/20 0.69
TSPO P30536 2/20 0.60
NR1I2 O75469 1/20 0.60
ABCB11 O95342 1/20 0.60
ALB P02768 1/20 0.60
ADORA3 P0DMS8 1/20 0.60
ADORA1 P30542 1/20 0.60
OPRM1 P35372 1/20 0.60
DRD3 P35462 1/20 0.60
OPRK1 P41145 1/20 0.60
PDE4D Q08499 1/20 0.60

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
SCHEMBL23624072 0.93 SLC2A2 (0.82) SLC2A2GABRA2GABRB2CYP1A2CYP2C9
SCHEMBL17719060 0.92 SLC2A2 (1.00) SLC2A2GABRA2GABRB2CYP1A2CYP2C9
SCHEMBL1430614 0.85 SLC2A2 (0.77) SLC2A2GABRB2CYP1A2CYP2C9CYP2C19
SCHEMBL3613601 0.84 SLC2A2 (0.69) SLC2A2CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL19723669 0.81 CYP1A2 (1.00) SLC2A2GABRA2GABRB2CYP1A2CYP2C9
SCHEMBL27500927 0.81 GABRA1 (0.72) SLC2A2GABRA2GABRB2HPGDTSPO
SCHEMBL1430336 0.79 GABRA2 (0.63) SLC2A2GABRA2GABRB2CYP1A2CYP2C9
SCHEMBL3038387 0.78 TSPO (0.67) SLC2A2GABRA2GABRB2ALDH1A1GAA
SCHEMBL23624382 0.78 GABRA2 (0.68) SLC2A2GABRA2GABRB2TSPONR1I2
SCHEMBL8150 0.78 GABRA2 (0.70) SLC2A2GABRA2GABRB2ALDH1A1TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682549-B1 IMIDAZO[1,2-A]PYRIDINE ANXIOLYTICS SEPRACOR INC (US) 2010-09-22 EP disclosed
US-7723324-B2 Imidazo[1,2-A]pyridine anxiolytics SEPRACOR, INC. (US) 2010-05-25 US disclosed
US-7566725-B2 Imidazo[1,2-A] pyridine anxiolytics SEPRACOR INC. (US) 2009-07-28 US disclosed
US-20080096867-A1 Imidazo[1,2-A] Pyridine Anxiolytics SEPRACOR INC. (US) 2008-04-24 US disclosed
US-20070043074-A1 IMIDAZO[1,2-A] PYRIDINE ANXIOLYTICS SEPRACOR INC. (US) 2007-02-22 US disclosed
US-7148353-B2 Imidazo[1,2-a] pyridine anxiolytics SEPRACOR INC. (US) 2006-12-12 US disclosed
EP-1682549-A2 IMIDAZO[1,2-A]PYRIDINE ANXIOLYTICS Sepracor Inc. (US) 2006-07-26 EP disclosed
US-20050171144-A1 Imidazo[1,2-a] pyridine anxiolytics SEPRACOR INC. (US) 2005-08-04 US disclosed
WO-2005044818-A2 IMIDAZO[1,2-A]PYRIDINE ANXIOLYTICS SEPRACOR, INC. (US) 2005-05-19 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 (3 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-20070043074-A1 IMIDAZO[1,2-A] PYRIDINE ANXIOLYTICS CNR1, CNR2, GABRA5 SLC2A2 4309/4885GABRA2 6/4885GABRB2 25/4885
US-20050171144-A1 Imidazo[1,2-a] pyridine anxiolytics CNR1, CNR2, GABRA5 SLC2A2 4309/4885GABRA2 6/4885GABRB2 25/4885
US-20080096867-A1 Imidazo[1,2-A] Pyridine Anxiolytics MTNR1B, ADORA2B, ADRA2B SLC2A2 4317/4885GABRA2 39/4885GABRB2 13/4885

“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.