SCHEMBL1885247

SCHEMBL1885247

CCOC(=O)c1cc2cc(NC(=O)c3ccccc3)ccc2s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.68
SMN1; SMN2 Q16637 6/20 0.60
NPC1 O15118 6/20 0.60
RAB9A P51151 5/20 0.60
GAA P10253 1/20 0.60
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
HPGD P15428 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
TP53 P04637 1/20 0.53
POLB P06746 1/20 0.53
THRB P10828 1/20 0.53
HTT P42858 1/20 0.51
PDGFRB P09619 2/20 0.51
KDR P35968 2/20 0.51
SENP5 Q96HI0 1/20 0.50
SENP2 Q9HC62 1/20 0.50

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
SCHEMBL15697561 0.88 HDAC1 (0.74) HDAC1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL15697580 0.82 HDAC1 (0.82) HDAC1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL3056527 0.82 MAPT (0.49) HDAC1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL1886609 0.81 HDAC1 (1.00) HDAC1PDGFRBKDRSENP5SENP2
SCHEMBL16395811 0.80 PTPN2 (0.47) HDAC1NPC1RAB9AGAAMAPT
SCHEMBL19433643 0.80 LMNA (0.48) HDAC1SMN1; SMN2NPC1RAB9AGAA
SCHEMBL24601427 0.79 MAPT (0.53) HDAC1SMN1; SMN2NPC1RAB9AGAA
SCHEMBL13709530 0.78 HDAC1 (0.74) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL23712812 0.77 TERT (0.49) HDAC1SMN1; SMN2NPC1RAB9AGAA
SCHEMBL16396158 0.77 MAPT (0.58) HDAC1GAAMAPTALDH1A1HPGD

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-7935724-B2 Thiophene and benzothiophene hydroxamic acid derivatives MERCK HDAC RESEARCH, LLC (US) 2011-05-03 US disclosed
US-20070213392-A1 Thiophene and Benzothiophene Hydroxamic Acid Derivatives MERCK HDAC RESEARCH, LLC 2007-09-13 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-20070213392-A1 Thiophene and Benzothiophene Hydroxamic Acid Derivatives BRDT, TXN, TXNRD2 HDAC1 9/4885SMN1; SMN2 1394/4885NPC1 3817/4885

“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.