SCHEMBL4875002

SCHEMBL4875002

O=C(NN=C(C=NO)c1cccc(Cl)c1)c1cc(Br)cc(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
CTSL P07711 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 2/20 0.42
OGG1 O15527 1/20 0.42
HTT P42858 1/20 0.42
KDM1A O60341 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MTOR P42345 2/20 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
SCHEMBL4874999 1.00 MAPT (0.47) MAPTALDH1A1CTSLSMN1; SMN2RAB9A
SCHEMBL4903094 0.93 MAPT (0.50) MAPTALDH1A1CTSLSMN1; SMN2RAB9A
SCHEMBL4886101 0.93 MAPT (0.50) MAPTALDH1A1CTSLSMN1; SMN2RAB9A
SCHEMBL4903099 0.93 MAPT (0.50) MAPTALDH1A1CTSLSMN1; SMN2RAB9A
SCHEMBL4886109 0.93 MAPT (0.50) MAPTALDH1A1CTSLSMN1; SMN2RAB9A
SCHEMBL4878056 0.90 MAPT (0.48) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL4878050 0.90 MAPT (0.48) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL2907122 0.90 MAPT (0.53) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL2907123 0.90 MAPT (0.53) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL4878943 0.87 MAPT (0.54) MAPTALDH1A1SMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227787-A1 Use of New Lipoxygenase Inhibitors BIOLIPOX AB (SE) 2008-09-18 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-20080227787-A1 Use of New Lipoxygenase Inhibitors ALOX15, ALOX15B, ALOX12 MAPT 4603/4885ALDH1A1 464/4885CTSL 666/4885

“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.