SCHEMBL7115336

SCHEMBL7115336

Nc1ccc(O)c(N)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP7 P55210 2/20 0.47
G6PD P11413 1/20 0.47
CASP6 P55212 1/20 0.47
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
KDM4E B2RXH2 5/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
THRB P10828 2/20 0.42
RECQL P46063 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
PTGS2 P35354 2/20 0.42
TNF P01375 1/20 0.42
HSPD1 P10809 1/20 0.42

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
SCHEMBL31634590 1.00 CASP7 (0.47) CASP7G6PDCASP6CA12CA1
SCHEMBL16431370 0.86 CA1 (0.54) CASP7G6PDCASP6CA12CA1
SCHEMBL1000209 0.85 KMT2A (0.44) CASP7G6PDCASP6CA12CA1
SCHEMBL15439886 0.84 CA12 (0.52) CASP7G6PDCASP6CA12CA1
SCHEMBL13202508 0.82 SELL (0.46) CASP7G6PDCASP6CA12CA1
SCHEMBL9490123 0.80 CASP7 (0.55) CASP7G6PDCASP6CA12CA1
SCHEMBL3822164 0.80 KMT2A (0.48) CASP6CA12CA1CA2CA7
SCHEMBL31348929 0.80 KMT2A (0.48) CASP6CA12CA1CA2CA7
SCHEMBL9719338 0.79 MAPT (0.50) CASP7G6PDCASP6KMT2AMEN1
SCHEMBL24752830 0.78 KEAP1 (0.42) CASP7G6PDCASP6CA12CA1

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-20030109682-A1 Maytansines and maytansine conjugates SANTI DANIEL (US) 2003-06-12 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-20030109682-A1 Maytansines and maytansine conjugates AREG, HDGF, GHITM CASP7 512/4885G6PD 614/4885CASP6 1198/4885

“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.