SCHEMBL20225806

SCHEMBL20225806

CC(=O)CCCOc1cccc(C(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
TSHR P16473 1/20 0.55
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PTGES O14684 1/20 0.51
ALOX5 P09917 1/20 0.51
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
CYSLTR2 Q9NS75 3/20 0.47
CYSLTR1 Q9Y271 3/20 0.47
NSD2 O96028 1/20 0.44
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43

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
SCHEMBL20225816 0.94 KDM4E (0.62) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20225817 0.94 KDM4E (0.62) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20231598 0.88 KDM4E (0.65) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL9121600 0.83 KDM4E (0.55) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20231599 0.82 KDM4E (0.66) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20231594 0.82 KDM4E (0.66) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20225809 0.82 KDM4E (0.55) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL14159004 0.82 KDM4E (0.58) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL14158999 0.80 KDM4E (0.60) KDM4ESMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL13349920 0.80 PLA2G4B (0.56) LMNATSHRKMT2AACACBACACA

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-20180155350-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2018-06-07 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-20180155350-A1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES SI, GLB1, MRPL21 KDM4E 3481/4885SMN1; SMN2 3924/4885ALDH1A1 3715/4885

“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.