SCHEMBL7537543

SCHEMBL7537543

CC(OC(N)=O)c1ccccc1-c1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.43
PTPRC P08575 2/20 0.42
F3 P13726 7/20 0.41
F10 P00742 2/20 0.41
F7 P08709 2/20 0.41
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
CYP2C8 P10632 1/20 0.39
CYP2C9 P11712 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PTPN11 Q06124 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
SRD5A2 P31213 2/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
SRD5A1 P18405 1/20 0.38

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
SCHEMBL7539754 0.86 MYC (0.45) CYP2C9KDM4EPTPN11KMT2A
SCHEMBL7541920 0.79 TTR (0.40) TTRPTPRCF3F10F7
SCHEMBL7539053 0.76 CA12 (0.41)
SCHEMBL7535243 0.75 GABRA1 (0.40) KDM4E
SCHEMBL28673920 0.75 ALDH1A1 (0.42) PTPRCKDM4E
SCHEMBL29369532 0.74 FOLH1 (0.59) TTRPTPRCCYP2C8CYP2C9KDM4E
SCHEMBL141961 0.72 KDM4E (0.55) TTRPTPRCCYP2C8CYP2C9KDM4E
SCHEMBL7539093 0.71 ALOX5 (0.35) HCRTR1HCRTR2KMT2A
SCHEMBL31014272 0.71 TTR (0.51) TTRPTPRCF10F7CYP2C8
SCHEMBL4915994 0.71 TTR (0.51) TTRPTPRCCYP2C8CYP2C9KDM4E

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 TTR 2691/4885PTPRC 2844/4885F3 1466/4885

“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.