SCHEMBL6134705

SCHEMBL6134705

O=C(On1nnc2ccccc21)c1ccc(-c2cnc3sc(-c4ccc(C5=CCN(C6CCCCC6)CC5)cc4)nn23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.40
MKNK2 Q9HBH9 8/20 0.40
HDAC3 O15379 3/20 0.39
HDAC4 P56524 3/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC7 Q8WUI4 3/20 0.39
HDAC2 Q92769 3/20 0.39
HDAC10 Q969S8 3/20 0.39
HDAC11 Q96DB2 3/20 0.39
HDAC8 Q9BY41 3/20 0.39
HDAC6 Q9UBN7 3/20 0.39
HDAC9 Q9UKV0 3/20 0.39
HDAC5 Q9UQL6 3/20 0.39
SIRT2 Q8IXJ6 2/20 0.35
ALOX15 P16050 2/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6133888 0.86 HDAC3 (0.43) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6134704 0.85 HDAC3 (0.39) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6538542 0.81 HDAC3 (0.51) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6132440 0.81 MKNK1 (0.41) MKNK1MKNK2HDAC3HDAC4HDAC1
Hydrochloric Acid SCHEMBL6135236 0.81 MKNK1 (0.47) MKNK1MKNK2
SCHEMBL6132395 0.80 MKNK1 (0.42) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6134883 0.75 HDAC3 (0.51) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6539291 0.74 HDAC3 (0.50) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6132243 0.74 HDAC3 (0.52) MKNK1MKNK2HDAC3HDAC4HDAC1
SCHEMBL6134287 0.74 HDAC3 (0.40) MKNK1MKNK2HDAC3HDAC4HDAC1

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 MKNK1 2695/4885MKNK2 3220/4885HDAC3 1145/4885

“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.