SCHEMBL3549883

SCHEMBL3549883

NC(=O)Nc1cccc2cccnc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
KDR P35968 3/20 0.69
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
MAPT P10636 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
TDP1 Q9NUW8 3/20 0.67
POLB P06746 2/20 0.67
CASP3 P42574 1/20 0.66
SENP8 Q96LD8 1/20 0.66
SENP7 Q9BQF6 1/20 0.66
KDM4E B2RXH2 2/20 0.64
HDAC6 Q9UBN7 1/20 0.61
RECQL P46063 1/20 0.61
HTT P42858 2/20 0.60
GAA P10253 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
ALDH1A1 P00352 3/20 0.59
RAB9A P51151 2/20 0.59

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
SCHEMBL29851236 0.84 KDR (0.71) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL1695444 0.84 KDR (0.71) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL2336735 0.83 MEN1 (0.72) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL4512999 0.83 CYP1A2 (1.00) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL29918706 0.83 TDP1 (0.71) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL14851783 0.83 TDP1 (0.69) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL1753903 0.83 TDP1 (0.79) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL27599095 0.83 TDP1 (0.67) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL3909349 0.83 TDP1 (0.67) CYP1A2CYP3A4KDRMEN1KMT2A
SCHEMBL5053488 0.83 TDP1 (0.71) CYP1A2CYP3A4KDRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741479-B2 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. (US) 2010-06-22 US disclosed
EP-1828169-A2 UREA INHIBITORS OF MAP KINASES Locus Pharmaceuticals, Inc. (US) 2007-09-05 EP disclosed
US-20060167247-A1 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. 2006-07-27 US disclosed
WO-2006062982-A2 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2006-06-15 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-20060167247-A1 Urea inhibitors of MAP kinases MAPK1, MAP3K1, MAP3K20 CYP1A2 1826/4885CYP3A4 3548/4885KDR 4129/4885

“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.