SCHEMBL2735296

SCHEMBL2735296

Cc1ccc(NC(=O)c2nc[nH]c2C(=O)Nc2nc3ccccc3[nH]2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.68
SMN1; SMN2 Q16637 5/20 0.61
NPC1 O15118 5/20 0.61
RAB9A P51151 5/20 0.61
TDP1 Q9NUW8 3/20 0.61
PKM P14618 3/20 0.61
GAA P10253 2/20 0.61
OPRK1 P41145 1/20 0.61
KLF5 Q13887 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
ALDH1A1 P00352 3/20 0.57
NPSR1 Q6W5P4 1/20 0.57
KDM4E B2RXH2 4/20 0.54
MAOB P27338 1/20 0.50
ADORA2A P29274 1/20 0.50
XBP1 P17861 1/20 0.49
MPO P05164 1/20 0.49
ADORA3 P0DMS8 1/20 0.49

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
SCHEMBL2735288 0.89 MAPT (0.64) MAPTSMN1; SMN2NPC1RAB9ATDP1
SCHEMBL2735286 0.89 MAPT (0.72) MAPTSMN1; SMN2NPC1RAB9ATDP1
SCHEMBL2735339 0.86 NPC1 (0.56) MAPTSMN1; SMN2NPC1RAB9ATDP1
SCHEMBL2735385 0.86 NPC1 (0.54) MAPTSMN1; SMN2NPC1RAB9APKM
SCHEMBL2759942 0.86 NPC1 (0.54) MAPTSMN1; SMN2NPC1RAB9ATDP1
SCHEMBL213366 0.85 RAB9A (0.57) MAPTSMN1; SMN2NPC1RAB9APKM
SCHEMBL2735268 0.85 GAA (0.65) MAPTSMN1; SMN2NPC1RAB9APKM
SCHEMBL216809 0.85 RAB9A (0.52) MAPTSMN1; SMN2NPC1RAB9APKM
SCHEMBL3330011 0.83 KMT2A (0.50) MAPTSMN1; SMN2NPC1RAB9APKM
SCHEMBL2735292 0.83 NPC1 (0.51) MAPTSMN1; SMN2NPC1RAB9APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 MAPT 2138/4885SMN1; SMN2 2516/4885NPC1 3307/4885

“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.