SCHEMBL6415698

SCHEMBL6415698

O=C(O)c1cccc(C=NNc2nc3nonc3nc2Nc2ccc(F)c(Cl)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.47
RAB9A P51151 7/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
MAPT P10636 5/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 2/20 0.47
BIRC5 O15392 1/20 0.46
CSNK2A1 P68400 7/20 0.42
CSNK2A2 P19784 2/20 0.42
CSNK2B P67870 2/20 0.42
GAA P10253 3/20 0.41
TP53 P04637 2/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
CCR2 P41597 1/20 0.41
CCR5 P51681 1/20 0.41
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40

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
SCHEMBL6435303 0.92 BIRC5 (0.48) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6417027 0.90 TDP1 (0.47) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6440252 0.87 MAPT (0.44) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6415963 0.86 BIRC5 (0.52) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6415955 0.85 BIRC5 (0.67) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6415953 0.85 BIRC5 (0.67) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6418326 0.82 GAA (0.47) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6431849 0.81 RAB9A (0.49) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6414866 0.80 BIRC5 (0.54) NPC1RAB9AMAPTKMT2AALDH1A1
SCHEMBL6414867 0.80 BIRC5 (0.54) NPC1RAB9AMAPTKMT2AALDH1A1

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 NPC1 2027/4885RAB9A 1136/4885SMN1; 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.