SCHEMBL1105708

SCHEMBL1105708

CNC(=O)c1ccc(NN)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CA2 P00918 1/20 0.55
PLK1 P53350 7/20 0.53
MMP13 P45452 1/20 0.48
PLAU P00749 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
PKM P14618 1/20 0.45
APEX1 P27695 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL250247 0.83 HDAC6 (0.80) HDAC2HDAC8HDAC6HPGDTSHR
SCHEMBL8306146 0.82 HDAC2 (0.64) HDAC2HDAC8HDAC6HPGDTSHR
SCHEMBL6469729 0.82 MPO (0.64) HTTCA2NPC1RAB9AMEN1
SCHEMBL18019596 0.80 NPC1 (0.69) HDAC2HDAC8HDAC6HPGDTSHR
Hydrochloric Acid SCHEMBL28169553 0.80 MPO (0.61) HTTCA2MEN1LMNAPOLB
SCHEMBL9787399 0.80 HDAC6 (0.56) HDAC2HDAC8HDAC6CA2
SCHEMBL15798566 0.79 HDAC2 (0.55) HDAC2HDAC8HDAC6HPGDTSHR
SCHEMBL15896350 0.78 HDAC2 (0.59) HDAC2HDAC8HDAC6HPGDTSHR
SCHEMBL1105657 0.77 ALDH1A1 (0.60) HDAC2HDAC8HDAC6SMN1; SMN2CA2
SCHEMBL1003914 0.77 HDAC2 (0.64) HDAC2HDAC8HDAC6HPGDTSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230194537-A1 COMPOUNDS FOR THE DETECTION OF GLYCANS Life Technologies Corporation 2023-06-22 US disclosed
US-8153100-B2 Methods and compositions for F-18 labeling of proteins, peptides and other molecules IMMUNOMEDICS, INC. (US) 2012-04-10 US disclosed
US-8147800-B2 Methods and compositions for F-18 labeling of proteins, peptides and other molecules IMMUNOMEDICS, INC. (US) 2012-04-03 US disclosed
US-20110280801-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2011-11-17 US disclosed
US-20090246130-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2009-10-01 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-20090246130-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules F13B, TFRC, F13A1 HDAC2 4534/4885HDAC8 3885/4885HDAC6 2982/4885
US-20110280801-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules TFRC, F13A1, S100A8 HDAC2 4562/4885HDAC8 2423/4885HDAC6 3032/4885

“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.