SCHEMBL6440251

SCHEMBL6440251

N/N=C(\c1cccc(O)c1)c1nc2nonc2nc1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
POLB P06746 1/20 0.41
CCR2 P41597 1/20 0.41
CCR5 P51681 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.39
AURKA O14965 1/20 0.38
RPS6KB1 P23443 1/20 0.38
EGFR P00533 3/20 0.37
KDR P35968 1/20 0.37
TDO2 P48775 7/20 0.36
BRAF P15056 1/20 0.36
GRM4 Q14833 2/20 0.36
IDO1 P14902 2/20 0.36

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
SCHEMBL6440257 1.00 TP53 (0.41) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6412976 0.91 MAPT (0.40) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6412964 0.91 MAPT (0.40) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6418314 0.89 MAPT (0.39) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6418336 0.89 MAPT (0.39) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6415683 0.89 CSNK2A1 (0.45) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6415701 0.89 CSNK2A1 (0.45) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6431148 0.88 TP53 (0.41) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6431156 0.88 TP53 (0.41) TP53MAPTSMN1; SMN2POLBCCR2
SCHEMBL6502277 0.87 SMN1; SMN2 (0.47) TP53MAPTSMN1; SMN2POLBCCR2

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 2 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

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 TP53 4485/4885MAPT 4420/4885SMN1; SMN2 4369/4885

“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.