SCHEMBL13409103

SCHEMBL13409103

CC(=O)Nc1nc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cs1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.64
KMT2A Q03164 6/20 0.58
MEN1 O00255 5/20 0.53
CSNK2A2 P19784 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
LMNA P02545 2/20 0.48
DYRK1A Q13627 1/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 2/20 0.46
HSP90AA1 P07900 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL13391012 0.87 LMNA (0.66) RAB9AKMT2AMEN1LMNAALDH1A1
SCHEMBL9621679 0.78 RAB9A (1.00) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL21382353 0.75 RAB9A (0.64) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL3932557 0.74 RAB9A (0.62) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL8934604 0.74 RAB9A (0.62) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL9845155 0.74 RAB9A (0.62) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL3932546 0.74 RAB9A (0.62) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL4875352 0.74 RAB9A (0.62) RAB9AKMT2AMEN1CSNK2A2CSNK2B
SCHEMBL3891683 0.74 KMT2A (1.00) KMT2AMEN1LMNAALDH1A1KDM4E
SCHEMBL9845157 0.73 RAB9A (0.61) RAB9AKMT2AMEN1CSNK2A2CSNK2B

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-20100093747-A1 METHOD OF INDUCING NEGATIVE CHEMOTAXIS CELTAXSYS, INC. 2010-04-15 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-20100093747-A1 METHOD OF INDUCING NEGATIVE CHEMOTAXIS PMAIP1, CDC42, DCX RAB9A 826/4885KMT2A 4738/4885MEN1 4129/4885

“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.