SCHEMBL7539101

SCHEMBL7539101

CC(OC(N)=O)Sc1ccccc1-c1ccccc1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
TSHR P16473 3/20 0.33
HTR2B P41595 2/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
THRB P10828 1/20 0.33
RAB9A P51151 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
ADORA2A P29274 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33

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
SCHEMBL7535634 0.89 CA12 (0.38) CA12CA1CA2CA7CA9
SCHEMBL7536344 0.83 MYC (0.42) CA12CA1CA2CA7CA9
SCHEMBL7545406 0.82 DRD1 (0.35) TSHRTHRBALDH1A1
SCHEMBL11288988 0.78 EPHX1 (0.34) TSHRMAPK1RAB9AALDH1A1MAPT
SCHEMBL7541920 0.77 TTR (0.40) ALDH1A1KDM4E
SCHEMBL7535243 0.74 GABRA1 (0.40) CA12CA1CA2CA7CA9
SCHEMBL465266 0.73 LMNA (0.41) TSHRMAPK1ALDH1A1KDM4EEPHX1
Urea SCHEMBL28397762 0.69 HPGD (0.54) CA12CA1CA2CA7CA9
SCHEMBL7537298 0.69 AKR1B1 (0.40) CA12CA1CA2CA7CA9
SCHEMBL27697867 0.69 CA12 (0.37) CA12CA1CA2CA7CA9

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 CA12 3997/4885CA1 1889/4885CA2 1428/4885

“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.