SCHEMBL2249683

SCHEMBL2249683

CC(=O)Nc1ccc2c(c1)OCC2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.69
CYP2C19 P33261 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
MAPT P10636 3/20 0.63
SMN1; SMN2 Q16637 4/20 0.50
LMNA P02545 1/20 0.50
AAK1 Q2M2I8 1/20 0.48
POLB P06746 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
ADRA2A P08913 1/20 0.48
MAOA P21397 1/20 0.48
SLC6A2 P23975 1/20 0.48
HTR2C P28335 1/20 0.48
SLC6A4 P31645 1/20 0.48
HTR2B P41595 1/20 0.48
GAA P10253 1/20 0.48
OGA O60502 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL2245426 0.87 CYP1A2 (0.69) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL19097952 0.84 MEN1 (0.55) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL8411387 0.84 CYP1A2 (0.56) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL5861384 0.81 CYP1A2 (1.00) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL30334729 0.80 CYP1A2 (0.63) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL5582783 0.80 CYP1A2 (0.63) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL10848884 0.79 CYP1A2 (0.87) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL29739444 0.78 CYP1A2 (0.65) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL2245406 0.78 CYP1A2 (0.65) CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2
SCHEMBL1182047 0.78 KDM4E (0.60) MAPTPOLBNPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
US-7989451-B2 Tricyclic 1,2,4-triazine oxides and compositions for therapeutic use in cancer treatments AUCKLAND UNISERVICES LIMITED (NZ) 2011-08-02 US disclosed
EP-1866292-B1 TRICYCLIC 1,2,4-TRIAZINE OXIDES AND COMPOSITIONS THEREFROM FOR THERAPEUTIC USE IN CANCER TREATMENTS AUCKLAND UNISERVICES LTD (NZ) 2010-12-15 EP disclosed
EP-1866292-B1 TRICYCLIC 1,2,4-TRIAZINE OXIDES AND COMPOSITIONS THEREFROM FOR THERAPEUTIC USE IN CANCER TREATMENTS AUCKLAND UNISERVICES LTD (NZ) 2010-12-15 EP disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
US-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments AUCKLAND UNISERVICES LIMITED (NZ) 2009-07-23 US disclosed
EP-1866292-A1 TRICYCLIC 1,2,4-TRIAZINE OXIDES AND COMPOSITIONS THEREFROM FOR THERAPEUTIC USE IN CANCER TREATMENTS Auckland Uniservices Limited (NZ) 2007-12-19 EP disclosed
WO-2006104406-A1 TRICYCLIC 1,2,4-TRIAZINE OXIDES AND COMPOSITIONS THEREFROM FOR THERAPEUTIC USE IN CANCER TREATMENTS AUCKLAND UNISERVICES LIMITED (NZ) 2006-10-05 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-20090186886-A1 Tricyclic 1,2,4-Triazine Oxides and Compositions for Therapeutic Use in Cancer Treatments HIF1AN, HIF1A, HYOU1 CYP1A2 42/4885CYP2C19 344/4885NPSR1 1263/4885

“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.