SCHEMBL22837809

SCHEMBL22837809

Cc1cccc(NC(=O)c2ccc(-c3cn[nH]c3)cc2OCc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 3/20 0.63
▸ LRRK2 Q5S007 4/20 0.58
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ ROCK2 O75116 7/20 0.51
▸ ROCK1 Q13464 5/20 0.51
▸ SGMS2 Q8NHU3 2/20 0.49
▸ FLT3 P36888 2/20 0.49
▸ LMNA P02545 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ CAMK2G Q13555 1/20 0.48
▸ CAMK2D Q13557 1/20 0.48
▸ MYLK Q15746 1/20 0.48
▸ MKNK2 Q9HBH9 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL20290499 0.91 MELK (0.74) MELKLRRK2MEN1KMT2AROCK2
SCHEMBL20291184 0.85 MELK (0.66) MELKLRRK2ROCK2ROCK1SGMS2
SCHEMBL4936884 0.82 LRRK2 (0.69) LRRK2MEN1KMT2ASGMS2LMNA
SCHEMBL20291125 0.81 MELK (0.73) MELKLRRK2ROCK2ROCK1SGMS2
SCHEMBL20290495 0.80 MELK (0.58) MELKLRRK2MEN1KMT2AROCK2
SCHEMBL3722812 0.78 MELK (0.55) MELKLRRK2ROCK2ROCK1MKNK2
SCHEMBL1649389 0.78 LRRK2 (0.84) LRRK2SGMS2
SCHEMBL20291124 0.76 MELK (0.52) MELKLRRK2ROCK2ROCK1FLT3
SCHEMBL20290501 0.75 LRRK2 (0.75) MELKLRRK2MEN1KMT2ASGMS2
SCHEMBL20291171 0.74 SGMS2 (0.74) LRRK2MEN1KMT2ASGMS2

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-10875844-B2 Salicylate inhibitors of MELK and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-12-29 — — 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-10875844-B2 Salicylate inhibitors of MELK and methods of use MELK, HIPK3, MINK1 MELK 1/4885LRRK2 177/4885MEN1 1213/4885

“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.

Send feedback