SCHEMBL10019306

SCHEMBL10019306

COc1ccc(Cn2ccc3ccnc(-c4ccc([N+](=O)[O-])cc4)c32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
SLC29A1 Q99808 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
PIK3CG P48736 1/20 0.46
KCNJ1 P48048 1/20 0.44
KCNH2 Q12809 1/20 0.44
HTT P42858 1/20 0.43
APP P05067 1/20 0.43
CCNE2 O96020 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
PTPN11 Q06124 1/20 0.41
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL10019329 0.89 CYP1A2 (0.43) SMN1; SMN2HTTNPC1RAB9AL3MBTL1
SCHEMBL10019309 0.84 CLK4 (0.48) MAPTSMN1; SMN2PIK3CAPIK3CBPIK3CG
SCHEMBL10019301 0.83 MET (0.51) MAPTKMT2AHTTLMNA
SCHEMBL10019319 0.83 MAPT (0.46) MAPTKMT2AMEN1NPC1
SCHEMBL10019304 0.83 NPC1 (0.44) NPC1RAB9A
SCHEMBL10019312 0.81 APP (0.42) MAPTAPPLMNA
SCHEMBL10019308 0.81 ACHE (0.46) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL652881 0.79 TUBB4A (0.63) MAPTSMN1; SMN2KMT2AMEN1PIK3CA
SCHEMBL18449581 0.76 APP (0.60) MAPTSMN1; SMN2KMT2AMEN1PIK3CA
SCHEMBL10019337 0.75 CYP1A2 (0.43) MAPTKMT2AMEN1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119683-B2 Aryl substituted sulfonamide compounds and their use as anticancer agents TAIPEI MEDICAL UNIVERSITY (TW) 2012-02-21 US disclosed
US-20110039880-A1 ARYL SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS ANTICANCER AGENTS TAIPEI MEDICAL UNIVERSITY (TW) 2011-02-17 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-20110039880-A1 ARYL SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS ANTICANCER AGENTS ARSA, SULT1E1, STS MAPT 4706/4885SMN1; SMN2 1118/4885SLC29A1 1829/4885

“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.