SCHEMBL23913809

SCHEMBL23913809

C=C1C(=O)OC(c2ccccc2)C1c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MAPK1 P28482 4/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
BLM P54132 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TDP2 O95551 1/20 0.39
ALOX12 P18054 1/20 0.39
CASP3 P42574 1/20 0.39
HTT P42858 1/20 0.39
GALK1 P51570 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX1 P07099 1/20 0.39
CYP19A1 P11511 2/20 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
SCHEMBL23914400 1.00 ALDH1A1 (0.47) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23913810 1.00 ALDH1A1 (0.47) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23914399 1.00 ALDH1A1 (0.47) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL30528491 0.89 MAPT (0.37) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL30528399 0.88 ALDH1A1 (0.47) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23913986 0.86 ALDH1A1 (0.40) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23913987 0.86 ALDH1A1 (0.40) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23913983 0.78 SMN1; SMN2 (0.39) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23913984 0.78 SMN1; SMN2 (0.39) ALDH1A1MAPK1KDM4ELMNAMAPT
SCHEMBL23914451 0.78 SMN1; SMN2 (0.39) ALDH1A1MAPK1KDM4ELMNAMAPT

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-20210317099-A1 SAFER, POTENT, AND FAST ACTING ANTIMICROBIAL AGENTS PURDUE RESEARCH FOUNDATION (US) 2021-10-14 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-20210317099-A1 SAFER, POTENT, AND FAST ACTING ANTIMICROBIAL AGENTS MIF, LTA, MGAM ALDH1A1 2164/4885MAPK1 2849/4885KDM4E 2541/4885

“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.