SCHEMBL20337758

SCHEMBL20337758

Cc1ccc(S(=O)(=O)OCC(=O)NC2CCc3nc(-c4ccc(-c5cc(C(F)(F)F)n(C)n5)cc4)cn3C2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 2/20 0.36
▸ HDAC4 P56524 2/20 0.36
▸ HDAC1 Q13547 2/20 0.36
▸ HDAC7 Q8WUI4 2/20 0.36
▸ HDAC2 Q92769 2/20 0.36
▸ HDAC10 Q969S8 2/20 0.36
▸ HDAC11 Q96DB2 2/20 0.36
▸ HDAC8 Q9BY41 2/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ HDAC9 Q9UKV0 2/20 0.36
▸ HDAC5 Q9UQL6 2/20 0.36
▸ NCOR2 Q9Y618 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ PTGER1 P34995 1/20 0.34
▸ WDR5 P61964 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ CCR2 P41597 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
SCHEMBL18281473 0.86 SMPD3 (0.38) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337675 0.79 STAT3 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337795 0.78 ALDH1A1 (0.37) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337612 0.78 RPS6KA5 (0.37) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337721 0.78 RPS6KA5 (0.37) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337602 0.74 GAA (0.30) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18281471 0.74 ALDH1A1 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18281442 0.73 WDR5 (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20337611 0.73 KHK (0.34) HDAC3HDAC4HDAC1HDAC7HDAC2
Hydrochloric Acid SCHEMBL20337635 0.70 LMNA (0.34) SMN1; SMN2POLBGAAWDR5ALDH1A1

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-10933049-B2 Mobilizing agents and uses therefor THE UNIVERSITY OF QUEENSLAND (AU) 2021-03-02 — — US disclosed
US-20180185328-A1 MOBILIZING AGENTS AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2018-07-05 — — 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-20180185328-A1 MOBILIZING AGENTS AND USES THEREFOR C3AR1, CSF3R, C5AR1 HDAC3 3289/4885HDAC4 2615/4885HDAC1 2510/4885
US-10933049-B2 Mobilizing agents and uses therefor C3AR1, CSF3R, C5AR1 HDAC3 3289/4885HDAC4 2615/4885HDAC1 2510/4885

“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.

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