SCHEMBL13045901

SCHEMBL13045901

N/N=c1\ccc2c(-c3ccccc3S(=O)(=O)O)c3ccc(N)cc3oc-2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.49
USP2 O75604 6/20 0.48
ATM Q13315 2/20 0.48
CFTR P13569 1/20 0.48
PAX8 Q06710 1/20 0.48
GOPC Q9HD26 1/20 0.48
L3MBTL1 Q9Y468 4/20 0.42
NSD2 O96028 3/20 0.42
NFKB1 P19838 2/20 0.42
PLCG1 P19174 2/20 0.42
CASP6 P55212 2/20 0.42
ALPL P05186 2/20 0.42
KDM4A O75164 1/20 0.42
TNNI3 P19429 1/20 0.42
TNNT2 P45379 1/20 0.42
MMP14 P50281 1/20 0.42
TNNC1 P63316 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36

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
SCHEMBL13045911 0.89 USP2 (0.48) ABCB1USP2ATMCFTRPAX8
SCHEMBL7970133 0.87 USP2 (0.54) ABCB1USP2ATMCFTRPAX8
SCHEMBL15355561 0.86 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
SCHEMBL3744889 0.86 ABCB1 (0.39) ABCB1USP2ATMCFTRPAX8
SCHEMBL3744887 0.86 ABCB1 (0.39) ABCB1USP2ATMCFTRPAX8
SCHEMBL13045840 0.86 ABCB1 (0.39) ABCB1USP2ATMCFTRPAX8
SCHEMBL13045887 0.85 ALDH1A1 (0.44) ABCB1USP2ATMCFTRPAX8
SCHEMBL19143845 0.80 KMT2A (0.49) ABCB1USP2ATMCFTRPAX8
SCHEMBL24226774 0.77 GNG2 (0.38) ABCB1USP2ATMCFTRPAX8
SCHEMBL17936619 0.77 USP2 (0.37) ABCB1USP2ATMCFTRPAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9389183-B2 Fluorogenic hydrazine-substituted compounds Life Technologies Corporation (US) 2016-07-12 US disclosed
US-8772487-B2 Fluorogenic hydrazine-substituted compounds Life Technologies Corporation (US) 2014-07-08 US disclosed
US-20130288911-A1 FLUOROGENIC HYDRAZINE-SUBSTITUTED COMPOUNDS Life Technologies Corporation 2013-10-31 US disclosed
US-20100291547-A1 FLUOROGENIC HYDRAZINE-SUBSTITUTED COMPOUNDS Life Technologies Corporation (US) 2010-11-18 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-20100291547-A1 FLUOROGENIC HYDRAZINE-SUBSTITUTED COMPOUNDS ALDH2, ALDH1A2, HLCS ABCB1 3051/4885USP2 3504/4885ATM 4506/4885

“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.