SCHEMBL2250349

SCHEMBL2250349

[O-][n+]1nc(NCCN2CCOCC2)nc2cc3c(cc21)CCC3

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
CYP3A4 P08684 1/20 0.42
THRB P10828 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.40
GRK6 P43250 1/20 0.40
CSF1R P07333 1/20 0.39
LMNA P02545 3/20 0.39
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
APP P05067 1/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 2/20 0.38
BACE1 P56817 1/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MITF O75030 1/20 0.38
POLB P06746 1/20 0.38
SMARCA2 P51531 1/20 0.38

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
SCHEMBL2243857 0.97 USP2 (0.40) USP2CYP3A4THRBMEN1KMT2A
SCHEMBL2246095 0.94 KDM4E (0.42) USP2KMT2ATSHRLMNAHPGD
SCHEMBL2244540 0.93 BCHE (0.41) USP2CYP3A4THRBKMT2ALMNA
SCHEMBL2244447 0.92 HRH3 (0.42) KMT2ATSHRLMNABCHEACHE
SCHEMBL2246009 0.90 ACP1 (0.36) ACHESMARCA2ACP1TOP2A
SCHEMBL2246141 0.90 ACP1 (0.36) ACHESMARCA2ACP1TOP2A
SCHEMBL6674061 0.84 MEN1 (0.43) CYP3A4MEN1KMT2ATSHRGRK6
SCHEMBL2248254 0.83 KDM4E (0.39) KMT2ATSHRLMNAHPGDKDM4E
SCHEMBL2246147 0.83 TLR7 (0.35) BCHEACHE
SCHEMBL6677381 0.81 APP (0.48) USP2CYP3A4MEN1KMT2ATSHR

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 6 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 claimed
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 claimed
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 claimed
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
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

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 USP2 1737/4885CYP3A4 155/4885THRB 669/4885

“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.