SCHEMBL4423752

SCHEMBL4423752

CCOC(=O)C=Cc1ccc(-c2csc(N)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CYP3A4 P08684 1/20 0.49
TTR P02766 1/20 0.48
DPP4 P27487 1/20 0.48
ALDH1A1 P00352 7/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPT P10636 5/20 0.46
RAB9A P51151 5/20 0.46
LTA4H P09960 5/20 0.46
NPC1 O15118 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MKNK1 Q9BUB5 1/20 0.46

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
SCHEMBL4423750 1.00 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL4429689 0.82 ABL1 (0.56) CA12CA1CA2CA7CA9
SCHEMBL4429688 0.82 ABL1 (0.56) CA12CA1CA2CA7CA9
SCHEMBL26246354 0.79 MAPT (0.52) CA12CA1CA2CA7CA9
SCHEMBL28750521 0.79 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL4743571 0.78 ALDH1A1 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4432735 0.78 KDM4E (0.54) ALDH1A1KDM4EMAPTRAB9ALTA4H
SCHEMBL4432736 0.78 KDM4E (0.54) ALDH1A1KDM4EMAPTRAB9ALTA4H
SCHEMBL10939791 0.78 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL5059085 0.78 CA12 (0.86) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682538-A4 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S BIO PTE LTD (SG) 2009-05-27 EP disclosed
US-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications A*BIO PTE LTD. (SG) 2007-07-19 US disclosed
EP-1682538-A1 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S*Bio Pte Ltd (SG) 2006-07-26 EP disclosed
WO-2005040161-A1 BIARYL LINKED HYDROXAMATES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S*BIO PTE LTD (SG) 2005-05-06 WO 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-20070167499-A1 Biaryl linked hydroxamates: preparation and pharmaceutical applications HDAC1, HDAC11, HDAC2 CA12 928/4885CA1 889/4885CA2 682/4885

“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.