SCHEMBL12117923

SCHEMBL12117923

O=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1cc(CN2CCNCC2)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 9/20 0.69
CCNC P24863 1/20 0.50
CDK8 P49336 1/20 0.50
PAICS P22234 1/20 0.49
HDAC3 O15379 2/20 0.47
CHRM3 P20309 5/20 0.46
BACE1 P56817 3/20 0.46
ACLY P53396 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
SCHEMBL1317664 0.95 HDAC1 (0.64) HDAC1CCNCCDK8PAICSHDAC3
SCHEMBL12117894 0.90 HDAC1 (0.59) HDAC1CCNCCDK8PAICSBACE1
SCHEMBL12117920 0.90 HDAC1 (0.55) HDAC1HDAC3BACE1ACLY
Hydrochloric Acid SCHEMBL1315802 0.89 HDAC1 (0.54) HDAC1HDAC3BACE1ACLY
SCHEMBL2569866 0.88 HDAC1 (0.69) HDAC1BACE1ACLY
SCHEMBL13206290 0.88 HDAC1 (0.56) HDAC1HDAC3BACE1ACLY
SCHEMBL12117908 0.87 HDAC1 (0.57) HDAC1HDAC3BACE1ACLY
SCHEMBL12117913 0.87 HDAC1 (0.59) HDAC1BACE1ACLY
SCHEMBL1316090 0.86 HDAC1 (0.54) HDAC1CCNCCDK8BACE1ACLY
SCHEMBL12117911 0.85 HDAC1 (0.58) HDAC1BACE1ACLY

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-8492582-B2 N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2013-07-23 US disclosed
US-8492582-B2 N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2013-07-23 US disclosed
US-20110275797-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2011-11-10 US disclosed
US-20110275797-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2011-11-10 US disclosed
WO-2010087430-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF 富山化学工業株式会社 (JP) 2010-08-05 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-20110275797-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF COL14A1, COL2A1, COL1A1 HDAC1 73/4885CCNC 3376/4885CDK8 4739/4885

“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.