SCHEMBL2385451

SCHEMBL2385451

COc1cc(OC)c(COc2cccc3oc(-c4cc(Br)cnc4N)nc23)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 11/20 0.37
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
SHMT2 P34897 1/20 0.35
SGMS2 Q8NHU3 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
ALOX12 P18054 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
P2RX3 P56373 1/20 0.34
P2RX2 Q9UBL9 1/20 0.34
POLB P06746 1/20 0.34
MET P08581 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL2385744 0.90 F2RL3 (0.40) F2RL3ALDH1A1MAPTSHMT2SGMS2
SCHEMBL2386233 0.88 F2RL3 (0.41) F2RL3ALDH1A1MAPTSHMT2NPC1
SCHEMBL2386664 0.75 SGMS2 (0.45) F2RL3ALDH1A1SGMS2NPC1RAB9A
SCHEMBL2387707 0.73 TOP2A (0.44) F2RL3MAPTNPC1RAB9AMEN1
SCHEMBL2386983 0.73 MET (0.41) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL2384705 0.73 KDM4E (0.44) ALDH1A1MAPTSHMT2NPC1RAB9A
SCHEMBL2385969 0.71 MET (0.39) ALDH1A1MAPTRAB9AMEN1KMT2A
SCHEMBL2384707 0.68 MET (0.63) ALDH1A1MAPTNPC1GAARAB9A
SCHEMBL14764726 0.66 NPC1 (0.37) ALDH1A1MAPTNPC1RAB9ANPSR1
SCHEMBL29858095 0.66 FYN (0.49) ALDH1A1SHMT2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017611-B2 Pyridine and pyrazine derivatives -083 ASTRAZENECA AB (SE) 2011-09-13 US disclosed
EP-2215085-B1 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2011-09-07 EP disclosed
US-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 ASTRAZENECA AB (SE) 2009-05-07 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-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 MKI67, CCND3, CCND1 F2RL3 2836/4885ALDH1A1 802/4885MAPT 2946/4885

“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.