SCHEMBL19090777

SCHEMBL19090777

CCCNC(CO)CN(C)C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
CNR1 P21554 1/20 0.48
ADRA1A P35348 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ABCC3 O15438 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL22071607 0.86 LMNA (0.33) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL10244087 0.82 LMNA (0.41) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL12956362 0.81
SCHEMBL3684685 0.77
SCHEMBL21029957 0.77
SCHEMBL2484741 0.75 LMNA (0.54) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL2489804 0.75 LMNA (0.54) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL2484735 0.75 LMNA (0.54) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL21870640 0.73
SCHEMBL15467024 0.72

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10246478-B2 Polyene macrolide derivative SHIONOGI & CO., LTD. (JP) 2019-04-02 US disclosed
US-20170190729-A1 POLYENE MACROLIDE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2017-07-06 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 (2 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-20170190729-A1 POLYENE MACROLIDE DERIVATIVE ERG28, RPL23, RPL10 LMNA 742/4885CNR1 4155/4885ADRA1A 4726/4885
US-10246478-B2 Polyene macrolide derivative ERG28, RPL23, RPL10 LMNA 742/4885CNR1 4155/4885ADRA1A 4726/4885

“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.