SCHEMBL4945666

SCHEMBL4945666

Cc1cccnc1Nc1ccccc1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ MAPK10 P53779 1/20 0.46
▸ KDM4E B2RXH2 5/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ EGFR P00533 2/20 0.46
▸ NOS3 P29474 1/20 0.46
▸ NOS1 P29475 1/20 0.46
▸ NOS2 P35228 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ KMT2A Q03164 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ SLC2A1 P11166 1/20 0.44
▸ NFKB1 P19838 1/20 0.44

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
SCHEMBL30395905 1.00 MAPT (0.47) MAPTL3MBTL1TDP1GAAMAPK10
SCHEMBL19477689 0.88 NOS3 (0.57) MAPTL3MBTL1TDP1GAAKDM4E
SCHEMBL11964418 0.86 HTT (0.47) MAPTL3MBTL1MAPK10KDM4ENPC1
SCHEMBL7982557 0.85 NPC1 (0.52) MAPTL3MBTL1TDP1MAPK10KDM4E
SCHEMBL29463915 0.81 MAPT (0.49) MAPTL3MBTL1TDP1GAAMAPK10
SCHEMBL19463250 0.81 MAPT (0.49) MAPTL3MBTL1TDP1GAAMAPK10
SCHEMBL1855480 0.79 NPC1 (0.46) MAPTL3MBTL1TDP1KDM4ENPC1
SCHEMBL28269273 0.79 SMN1; SMN2 (0.54) MAPTGAAMAPK10KDM4EEGFR
SCHEMBL15368480 0.79 NPC1 (0.61) MAPTL3MBTL1TDP1GAAKDM4E
SCHEMBL29581676 0.79 MAPT (0.50) MAPTTDP1GAAMAPK10KDM4E

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 MAPT 97/4885L3MBTL1 4326/4885TDP1 367/4885

“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.

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