SCHEMBL25494239

SCHEMBL25494239

CC(C)NC(=O)CCOCCOCCC(=O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPK1 P28482 2/20 0.43
FAAH O00519 1/20 0.43
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
NLRP1 Q9C000 1/20 0.36
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
LMNA P02545 2/20 0.31
RXFP1 Q9HBX9 1/20 0.30
EPHX2 P34913 1/20 0.30

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
SCHEMBL26382110 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751712 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751713 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL25818821 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751718 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751710 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751715 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL18751714 0.84 MEN1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL25494347 0.84 MEN1 (0.42) MEN1KMT2AMAPK1FAAHHPGD
SCHEMBL24212536 0.83 MEN1 (0.44) MEN1KMT2AMAPK1FAAHHPGD

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-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 US disclosed
US-20230158153-A1 PI3 KINASE INHIBITORS AND USES THEREOF PURDUE RESEARCH FOUNDATION 2023-05-25 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-20230158153-A1 PI3 KINASE INHIBITORS AND USES THEREOF MMP1, PIK3CA, AKT2 MEN1 3624/4885KMT2A 4319/4885MAPK1 199/4885
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 MEN1 2971/4885KMT2A 4193/4885MAPK1 1961/4885

“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.