SCHEMBL19166754

SCHEMBL19166754

Nc1cc2c(cc1Cl)NCNS2(=O)=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.64
CA1 P00915 4/20 0.64
LMNA P02545 3/20 0.64
CYP2C9 P11712 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
THRB P10828 1/20 0.64
APEX1 P27695 1/20 0.64
HTR2B P41595 1/20 0.64
PMP22 Q01453 1/20 0.64
CA12 O43570 5/20 0.49
CA9 Q16790 4/20 0.49
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.35
CA7 P43166 2/20 0.34
HTT P42858 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL14340040 0.81 CA2 (0.61) CA2CA1LMNACYP2C9SMN1; SMN2
SCHEMBL8429639 0.80 CA2 (0.60) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL156490 0.78 LMNA (1.00) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL9349 0.78 LMNA (1.00) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL10778059 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL27630714 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL27674482 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL9508286 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL10408471 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2
Hydrochlorothiazide SCHEMBL1333333 0.77 LMNA (0.97) CA2CA1LMNACYP2C9SMN1; SMN2

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-20170209425-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING UNIV CASE WESTERN RESERVE (US) 2017-07-27 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-20170209425-A1 METHODS AND COMPOSITIONS FOR TREATING PATHOLOGIES ASSOCIATED WITH BDNF SIGNALING NTRK2, BDNF, NGF CA2 2854/4885CA1 1283/4885LMNA 3206/4885

“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.