SCHEMBL2233633

SCHEMBL2233633

CCOC(=O)c1ncn2c1COc1ccccc1-2

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 11/20 0.59
GABRB3 P28472 11/20 0.59
GABRA5 P31644 11/20 0.59
GABRA2 P47869 2/20 0.58
GABRA1 P14867 1/20 0.58
GABRA3 P34903 1/20 0.58
GABRB2 P47870 1/20 0.54
HTR1A P08908 1/20 0.49
CYP2C9 P11712 1/20 0.49
HTR1D P28221 1/20 0.49
HTR1B P28222 1/20 0.49
SLC6A4 P31645 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL7634522 0.84 GABRG2 (0.62) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL8866535 0.83 ALDH1A1 (0.48) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL14321045 0.82 HTR1A (0.55) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL2236417 0.81 GABRG2 (0.60) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL430171 0.79 HTR1A (0.51) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL2233500 0.79 GABRG2 (0.58) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL426964 0.79 HTR1A (0.58) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL430212 0.78 HTR1A (0.57) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL427036 0.78 HTR1A (0.62) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL13002475 0.78 GABRG2 (0.57) GABRG2GABRB3GABRA5GABRA2GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625982-B1 4-OXO- AND 4H-IMIDAZO(5,1-C)(1,4)BENZOXAZINES USEFUL AS BENZODIAZEPINE RECEPTOR-BINDING AGENTS UPJOHN CO (US) 2002-06-12 EP claimed
US-4880799-A CENTRAL NERVOUS SYSTEM DISORDERS, ANTICONVULSANTS A/S FERROSAN (DK) 1989-11-14 US claimed
US-20110213143-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-01 US disclosed
EP-2361910-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY Taisho Pharmaceutical Co., Ltd. (JP) 2011-08-31 EP disclosed
EP-0625982-B1 4-OXO- AND 4H-IMIDAZO(5,1-C)(1,4)BENZOXAZINES USEFUL AS BENZODIAZEPINE RECEPTOR-BINDING AGENTS UPJOHN CO (US) 2002-06-12 EP disclosed
US-5610158-A ANXIOLYTIC AGENTS, SEDATIVES THE UPJOHN COMPANY (US) 1997-03-11 US disclosed
EP-0625982-A1 4-OXO- AND 4H-IMIDAZO(5,1-C)(1,4)BENZOXAZINES USEFUL AS BENZODIAZEPINE RECEPTOR-BINDING AGENTS PHARMACIA & UPJOHN COMPANY (US) 1994-11-30 EP disclosed
WO-1993016082-A1 4-OXO- AND 4H-IMIDAZO(5,1-C)(1,4)BENZOXAZINES USEFUL AS BENZODIAZEPINE RECEPTOR-BINDING AGENTS THE UPJOHN COMPANY (US) 1993-08-19 WO disclosed
US-4886797-A CENTRAL NERVOUS SYSTEM DISORDERS A/S FERROSAN (DK) 1989-12-12 US disclosed
US-4880799-A CENTRAL NERVOUS SYSTEM DISORDERS, ANTICONVULSANTS A/S FERROSAN (DK) 1989-11-14 US disclosed
US-4870073-A CENTRAL NERVOUS SYSTEM DISORDERS, ANTHELMINTICS, PARASITICIDES, INSECTICIDES A/S FERROSAN (DK) 1989-09-26 US disclosed
EP-0220845-A1 Heterocyclic compounds and their preparation and use A/S FERROSAN (DK) 1987-05-06 EP 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-20110213143-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY TAF1, TAF5, TAF11 GABRG2 2731/4885GABRB3 1763/4885GABRA5 1685/4885

“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.