SCHEMBL1787095

SCHEMBL1787095

Nc1nc(Cl)c2c(n1)N(Cc1nc3ccccc3o1)C(=O)C2=Cc1ccc[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32

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
SCHEMBL1787092 1.00 MAPT (0.33) MAPTSMN1; SMN2MAPK1L3MBTL1HDAC3
SCHEMBL1787087 1.00 MAPT (0.33) MAPTSMN1; SMN2MAPK1L3MBTL1HDAC3
SCHEMBL1789987 0.86 TLK2 (0.33) MAPTSMN1; SMN2MAPK1HDAC3HDAC4
SCHEMBL1789969 0.86 TLK2 (0.33) MAPTSMN1; SMN2MAPK1HDAC3HDAC4
SCHEMBL1789979 0.86 TLK2 (0.33) MAPTSMN1; SMN2MAPK1HDAC3HDAC4
SCHEMBL27831896 0.78 LOXL2 (0.31) MAPTSMN1; SMN2MEN1KMT2ALOXL2
SCHEMBL1788483 0.76 MAPT (0.34) MAPTSMN1; SMN2MAPK1L3MBTL1ALDH1A1
SCHEMBL1788481 0.76 MAPT (0.34) MAPTSMN1; SMN2MAPK1L3MBTL1ALDH1A1
SCHEMBL1788485 0.76 MAPT (0.34) MAPTSMN1; SMN2MAPK1L3MBTL1ALDH1A1
SCHEMBL1786838 0.76 MAPT (0.35) MAPTSMN1; SMN2MAPK1L3MBTL1ALDH1A1

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-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PONIARD PHARMACEUTICALS, INC. 2011-05-26 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-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PARK7, BDNF, BACE1 MAPT 26/4885SMN1; SMN2 11/4885MAPK1 1938/4885

“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.