SCHEMBL2937274

SCHEMBL2937274

COC(=O)Cc1c(-c2ccc(C)cc2C)nc2ccccn12

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.50
ALDH1A1 P00352 4/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 1/20 0.43
HSD17B10 Q99714 2/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
KCNK3 O14649 2/20 0.42
KCNK9 Q9NPC2 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL13341900 0.79 ALDH1A1 (0.61) ALDH1A1KDM4EHSD17B10PKMHPGD
SCHEMBL2930904 0.70 GABRA1 (0.70) ALDH1A1KDM4EHSD17B10HPGDSMN1; SMN2
SCHEMBL3613601 0.70 SLC2A2 (0.69) ALDH1A1MAPK1KDM4EGAAHSD17B10
SCHEMBL12499140 0.69 TACR1 (0.44) ALDH1A1KDM4EGAAHPGD
SCHEMBL2120778 0.68 KDM4E (0.51) DPP4ALDH1A1MAPK1KDM4EGAA
SCHEMBL7986855 0.68 KDM4E (0.56) ALDH1A1KDM4EGAAHPGDCYP2C9
SCHEMBL25450668 0.68 ALPL (0.43) ALDH1A1KDM4EHSD17B10HPGDSMN1; SMN2
SCHEMBL31190884 0.68 MAPK10 (0.56) GAACYP1A2CYP2C9CYP2C19
SCHEMBL31190916 0.68 NPC1 (0.43) DPP4GAACYP1A2CYP2C9CYP2C19
SCHEMBL16922185 0.67 GABRA1 (0.76) ALDH1A1MAPK1KDM4EHSD17B10HPGD

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 DPP4 3290/4885ALDH1A1 300/4885MAPK1 1280/4885
US-20050171144-A1 Imidazo[1,2-a] pyridine anxiolytics CNR1, CNR2, GABRA5 DPP4 3290/4885ALDH1A1 300/4885MAPK1 1280/4885
US-20080096867-A1 Imidazo[1,2-A] Pyridine Anxiolytics MTNR1B, ADORA2B, ADRA2B DPP4 3370/4885ALDH1A1 321/4885MAPK1 2786/4885

“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.