SCHEMBL4883205

SCHEMBL4883205

O=C(N/N=C(\C=N/O)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.61
MEN1 O00255 6/20 0.61
RAB9A P51151 6/20 0.61
NPC1 O15118 5/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
CYP2C19 P33261 2/20 0.61
NFKB1 P19838 1/20 0.61
CASP3 P42574 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
SENP6 Q9GZR1 1/20 0.61
MAPT P10636 9/20 0.58
ALDH1A1 P00352 7/20 0.58
KDM4E B2RXH2 4/20 0.58
TDP1 Q9NUW8 2/20 0.50
POLB P06746 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL4883211 1.00 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4887969 1.00 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4887975 1.00 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL5715915 0.91 NPC1 (0.53) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL5715919 0.91 NPC1 (0.53) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4888888 0.88 CYP1A2 (0.64) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4888895 0.88 CYP1A2 (0.64) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4883238 0.87 ALDH1A1 (0.54) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4883234 0.87 ALDH1A1 (0.54) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL4878016 0.86 NPC1 (0.59) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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 KMT2A 3684/4885MEN1 4240/4885RAB9A 3811/4885

“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.