SCHEMBL18876543

SCHEMBL18876543

Cc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.79
ECE2 P0DPD6 2/20 0.79
ECE1 P42892 2/20 0.79
MUS81 Q96NY9 2/20 0.79
L3MBTL1 Q9Y468 1/20 0.68
AR P10275 2/20 0.64
MEN1 O00255 6/20 0.62
KMT2A Q03164 6/20 0.62
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
NTRK1 P04629 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
PGR P06401 1/20 0.57
RRM1 P23921 1/20 0.56
SIRT1 Q96EB6 1/20 0.56
FTO Q9C0B1 1/20 0.56
POLB P06746 3/20 0.55
MAPT P10636 2/20 0.53

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
SCHEMBL25474226 1.00 DNM1 (0.79) DNM1ECE2ECE1MUS81L3MBTL1
SCHEMBL13074793 0.90 DNM1 (0.79) DNM1ECE2ECE1MUS81L3MBTL1
SCHEMBL18876548 0.89 DNM1 (0.70) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL30961945 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL847982 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL29385895 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL30917221 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL16342920 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL4570231 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1
Dynasore SCHEMBL29695524 0.88 DNM1 (1.00) DNM1ECE2ECE1MUS81L3MBTL1

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-20170144965-A1 MARMELIN ANALOGS AND METHODS OF USE IN CANCER TREATMENT THE UNIVERSITY OF KANSAS 2017-05-25 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 (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-20170144965-A1 MARMELIN ANALOGS AND METHODS OF USE IN CANCER TREATMENT COIL, MUC1, MAN2B2 DNM1 3453/4885ECE2 4650/4885ECE1 4299/4885

“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.