SCHEMBL23914414

SCHEMBL23914414

CCCCC[C@@H]1CC(CN2CCCCC2)C(=O)O1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
HPGD P15428 1/20 0.47
LMNA P02545 3/20 0.46
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
CYP1A2 P05177 2/20 0.41

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
SCHEMBL3657694 0.81 HTT (0.59) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL3658650 0.80 HTT (0.62) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL9450633 0.80 HTT (0.58) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL8095290 0.77 HTT (0.52) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL14973545 0.76 KMT2A (0.60) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL864222 0.76 HTT (0.54) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL14994325 0.75 KMT2A (0.51) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL9450597 0.75 KMT2A (0.55) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL9450600 0.75 KMT2A (0.55) ALDH1A1KDM4ETDP1HPGDLMNA
SCHEMBL9450601 0.75 KMT2A (0.55) ALDH1A1KDM4ETDP1HPGDLMNA

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 2164/4885KDM4E 2541/4885TDP1 4470/4885

“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.