SCHEMBL17512440

SCHEMBL17512440

C=CCc1ccc(C(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 13/20 0.62
CASP6 P55212 1/20 0.60
TSHR P16473 2/20 0.55
LMNA P02545 1/20 0.55
APEX1 P27695 1/20 0.51
KMT2A Q03164 1/20 0.48
PDK1 Q15118 1/20 0.48

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
SCHEMBL425321 0.88 CASP6 (0.60) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL20757 0.82 PDK1 (0.68) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL1483517 0.82 CASP6 (0.66) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL30481076 0.82 CASP6 (0.66) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL6341472 0.82 CASP6 (0.66) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL1251308 0.81 CASP6 (0.64) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL18833531 0.81 CASP6 (0.64) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL8092214 0.81 CASP6 (0.64) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL40979 0.81 CASP6 (0.64) HCAR3CASP6TSHRLMNAAPEX1
SCHEMBL2292095 0.81 CASP6 (0.64) HCAR3CASP6TSHRLMNAAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9688637-B2 3-amidobenzamides and uses thereof for increasing cellular levels of A3G and other A3 family members NORTHWESTERN UNIVERSTIY (US) 2017-06-27 US disclosed
US-20160052870-A1 3-AMIDOBENZAMIDES AND USES THEREOF FOR INCREASING CELLULAR LEVELS OF A3G AND OTHER A3 FAMILY MEMBERS NORTHWESTERN UNIVERSITY (US) 2016-02-25 US disclosed
WO-2016029136-A1 3-AMIDOBENZAMIDES AND USES THEREOF FOR INCREASING CELLULAR LEVELS OF A3G NORTHWESTERN UNIVERSITY (US) 2016-02-25 WO 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-20160052870-A1 3-AMIDOBENZAMIDES AND USES THEREOF FOR INCREASING CELLULAR LEVELS OF A3G AND OTHER A3 FAMILY MEMBERS L3MBTL3, AFG3L2, AMPD3 HCAR3 1231/4885CASP6 1568/4885TSHR 3838/4885

“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.