SCHEMBL25062344

SCHEMBL25062344

CCCNC(=O)CC(C)(C)COC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.40
KDM4C Q9H3R0 1/20 0.38
KMT2A Q03164 3/20 0.36
GAA P10253 2/20 0.36
TSHR P16473 1/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
EPHX1 P07099 2/20 0.33
MEN1 O00255 2/20 0.33
BCHE P06276 1/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR1 P21554 2/20 0.33
CASP2 P42575 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL22060943 0.82 MCL1 (0.38) MCL1KDM4CKMT2AGAAMMP1
SCHEMBL21307803 0.80 MCL1 (0.45) MCL1KDM4CKMT2AGAATSHR
SCHEMBL20613710 0.79 MCL1 (0.44) MCL1KDM4CKMT2AGAATSHR
SCHEMBL2730881 0.76 MCL1 (0.48) MCL1KDM4CKMT2AGAAMMP1
SCHEMBL24245455 0.76 MCL1 (0.41) MCL1KDM4CKMT2AGAATSHR
SCHEMBL4311511 0.74 MCL1 (0.47) MCL1KDM4CKMT2AGAATSHR
SCHEMBL25062707 0.74 ACACB (0.30)
SCHEMBL23477152 0.74 TSHR (0.31) TSHR
SCHEMBL22645790 0.73 KDM4C (0.40) MCL1KDM4CKMT2AMMP1MMP2
SCHEMBL27142716 0.73 ACHE (0.40) KMT2AMMP2EPHX1MEN1CASP2

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-20230057350-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-02-23 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-20230057350-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS BTN3A1, ANTXR2, CLTA MCL1 322/4885KDM4C 3707/4885KMT2A 1268/4885

“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.