SCHEMBL21160459

SCHEMBL21160459

CN(CCCC(=O)O)c1ccc2nc(C=O)oc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP14 P50281 1/20 0.39
SCP2 P22307 1/20 0.39
TMPRSS15 P98073 2/20 0.37
SRC P12931 2/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
BRD4 O60885 1/20 0.34
FFAR4 Q5NUL3 4/20 0.33
HDAC3 O15379 1/20 0.33
PTGS1 P23219 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
SLC16A3 O15427 1/20 0.33
SLC16A1 P53985 1/20 0.33

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
SCHEMBL21036961 0.84 MAPT (0.36) MAPTLMNATP53POLB
SCHEMBL24999938 0.77 TERT (0.42) MAPTSLC16A3PDE3BPDE3A
SCHEMBL25485822 0.76 MMP14 (0.40) MMP14SCP2TMPRSS15MAPTTP53
SCHEMBL13931380 0.76 EGFR (0.38) SCP2SRCMAPTLMNASLC16A3
Hydrochloric Acid SCHEMBL27091602 0.76 APAF1 (0.39) MMP14SCP2TMPRSS15MAPTTP53
SCHEMBL20390463 0.72 CYBB (0.40) MMP14
SCHEMBL21160609 0.70 SLC16A3 (0.41) SLC16A3SLC16A1
SCHEMBL25997304 0.70 MAPT (0.54) MAPTLMNATP53SLC16A3SLC16A1
SCHEMBL21160422 0.69 MMP14 (0.40) MMP14TMPRSS15FFAR4HDAC3PTGS1
SCHEMBL25997323 0.69 SLC16A3 (0.38) SCP2SRCMAPTLMNATP53

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-11209437-B2 Fluorescent probe and preparation method and use thereof FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY (CN) 2021-12-28 US disclosed
US-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-06-20 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-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF HNRNPF, HNRNPUL2, RAB5IF MMP14 2452/4885SCP2 2847/4885TMPRSS15 1248/4885
US-11209437-B2 Fluorescent probe and preparation method and use thereof HNRNPF, HNRNPUL2, RAB5IF MMP14 2452/4885SCP2 2847/4885TMPRSS15 1248/4885

“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.