SCHEMBL26971196

SCHEMBL26971196

CC(C)C12CCC(NC(=O)OC(C)(C)C)(CC1)CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
CTSL P07711 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
APLNR P35414 1/20 0.35
CA12 O43570 1/20 0.34
CA14 Q9ULX7 1/20 0.34
DGAT1 O75907 1/20 0.33
CYP2D6 P10635 1/20 0.33
CTSK P43235 2/20 0.33
GAA P10253 1/20 0.33
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
CTSS P25774 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
NFKB1 P19838 1/20 0.31

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
SCHEMBL23192205 0.86 MEN1 (0.39) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL17586280 0.84 MEN1 (0.40) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL25373767 0.82 CTSL (0.36) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL25373770 0.82 CTSL (0.36) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL25375179 0.82 CTSL (0.36) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL29363069 0.81 MEN1 (0.35) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL25992127 0.80 MEN1 (0.41) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL24031854 0.80 MEN1 (0.41) MEN1KMT2AMAPK1CTSLAPLNR
SCHEMBL31075527 0.79 MEN1 (0.41) MEN1KMT2AMAPK1CTSLCA1
SCHEMBL20575845 0.79 MEN1 (0.41) MEN1KMT2AMAPK1CTSLAPLNR

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-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 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-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 MEN1 3320/4885KMT2A 1467/4885MAPK1 1021/4885

“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.