SCHEMBL4943735

SCHEMBL4943735

CCc1ccc(Nc2ccccc2N)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.51
MAPK10 P53779 1/20 0.46
MAPT P10636 4/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HDAC1 Q13547 9/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
STAT1 P42224 1/20 0.39
PIK3CA P42336 1/20 0.39
PRKDC P78527 1/20 0.39
HDAC3 O15379 2/20 0.39

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
SCHEMBL13462816 0.78 SYK (0.48) SYKMAPTGAAKDM4EMEN1
SCHEMBL152586 0.77 HCAR3 (0.51) SYKMAPTKDM4EMEN1KMT2A
SCHEMBL4940849 0.76 MAPT (0.48) SYKMAPTGAAKDM4EMEN1
SCHEMBL154709 0.76 CXCR4 (0.49) SYKMAPK10GAAKDM4EMEN1
SCHEMBL9995147 0.76 MAPK10 (0.50) MAPK10MAPTGAAKDM4EMEN1
SCHEMBL3847392 0.76 MAPK10 (0.50) MAPK10MAPTGAAKDM4EMEN1
SCHEMBL15081850 0.75 MAPT (0.65) MAPTGAAKDM4EMEN1KMT2A
SCHEMBL16645370 0.74 HDAC1 (0.50) MAPK10MAPTKDM4EMEN1KMT2A
SCHEMBL10124754 0.72 MAPK10 (0.50) MAPK10MAPTGAAKDM4EMEN1
SCHEMBL18134036 0.72 HDAC1 (0.46) MAPTHDAC1HDAC2

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-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-03 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-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 SYK 1521/4885MAPK10 1199/4885MAPT 97/4885

“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.