SCHEMBL6415997

SCHEMBL6415997

N/N=C(\c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1)c1nc2nonc2nc1Nc1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.42
ALDH1A1 P00352 8/20 0.42
KDM4E B2RXH2 8/20 0.42
POLB P06746 5/20 0.42
KMT2A Q03164 11/20 0.40
MEN1 O00255 9/20 0.40
GAA P10253 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HPGD P15428 2/20 0.40
ALOX12 P18054 1/20 0.40
LDHA P00338 1/20 0.37
LDHB P07195 1/20 0.37
PTGS2 P35354 1/20 0.37
HAO1 Q9UJM8 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.36
DUSP3 P51452 2/20 0.36
TDP1 Q9NUW8 6/20 0.35
PKM P14618 3/20 0.35
RECQL P46063 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35

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
SCHEMBL6416006 1.00 MAPT (0.42) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6435669 0.93 MAPT (0.44) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6433045 0.92 KDM4E (0.45) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6422204 0.92 KDM4E (0.44) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6432253 0.89 RPA1 (0.44) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6415140 0.88 MAPT (0.42) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6416293 0.84 ALDH1A1 (0.41) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6435513 0.83 ALDH1A1 (0.50) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6435522 0.83 ALDH1A1 (0.50) MAPTALDH1A1KDM4EPOLBKMT2A
SCHEMBL6414388 0.83 ALDH1A1 (0.43) MAPTALDH1A1KDM4EPOLBKMT2A

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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 US disclosed
WO-2005044270-A1 OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS 4SC AG (DE) 2005-05-19 WO disclosed
EP-1529531-A1 Oxadiazolopyrazine derivatives as pharmaceutically active compounds 4SC AG (DE) 2005-05-11 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 MAPT 4420/4885ALDH1A1 1119/4885KDM4E 3277/4885

“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.