SCHEMBL3553019

SCHEMBL3553019

COC(=O)CN(S)C(=O)Nc1noc2ccc(C)cc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.43
TP53 P04637 5/20 0.42
POLB P06746 2/20 0.42
STK17B O94768 1/20 0.40
HTR2C P28335 1/20 0.40
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2768876 0.85 TP53 (0.52) MAPTTP53
SCHEMBL2786779 0.82 MAPT (0.43) MAPTTP53POLBSTK17BHTR2C
SCHEMBL3564260 0.76 MAPT (0.44) MAPTTP53POLBSTK17BHTR2C
SCHEMBL18727404 0.75 MAPT (0.52) MAPTTP53POLBSTK17BHTR2C
SCHEMBL21240884 0.73 MAPT (0.46) MAPTTP53POLBSTK17BHTR2C
SCHEMBL2787494 0.73 TP53 (0.40) MAPTTP53POLBHTR2CLMNA
SCHEMBL2437851 0.69 TP53 (0.56) MAPTTP53POLBLMNAMEN1
SCHEMBL2440241 0.69 SMN1; SMN2 (0.58) MAPTTP53POLBMEN1KMT2A
SCHEMBL2441879 0.68 MAPT (0.46) MAPTTP53POLBHTR2CTDP1
SCHEMBL2440202 0.68 SMN1; SMN2 (0.68) MAPTTP53LMNAMEN1HTT

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-7696238-B2 Substituted benzo[d]isoxazol-3-yl amine compounds as analgesics GRUENENTHAL GMBH (DE) 2010-04-13 US disclosed
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics GRUENENTHAL GMBH (DE) 2008-07-24 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-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics KCNQ1, KCNQ2, KCNQ3 MAPT 2492/4885TP53 4784/4885POLB 4243/4885

“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.