SCHEMBL1316946

SCHEMBL1316946

O=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1cc(-c2ccncc2)ccc1O.[NaH]

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 10/20 0.62
ACLY P53396 4/20 0.57
ACMSD Q8TDX5 3/20 0.55
HNF4A P41235 2/20 0.55
DHFR P00374 1/20 0.55
MCL1 Q07820 1/20 0.55
HDAC2 Q92769 2/20 0.51
CHUK O15111 1/20 0.50
HDAC3 O15379 1/20 0.48
CDC7 O00311 1/20 0.46
ROCK2 O75116 1/20 0.46
MAP4K4 O95819 1/20 0.46
GSK3B P49841 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
MKNK2 Q9HBH9 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
SCHEMBL1316465 0.99 HDAC1 (0.63) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1317748 0.91 HDAC1 (0.60) HDAC1ACLYACMSDHNF4AHDAC2
SCHEMBL1318525 0.91 ACLY (0.67) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1316020 0.88 HDAC1 (0.62) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1316942 0.88 HDAC1 (0.59) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1319925 0.87 ACLY (0.56) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1315416 0.87 ACLY (0.59) HDAC1ACLYACMSDHNF4ADHFR
SCHEMBL1317382 0.87 ACLY (0.50) HDAC1ACLYMCL1
SCHEMBL1317590 0.85 ACLY (0.51) HDAC1ACLYMCL1
SCHEMBL1317109 0.85 HDAC1 (0.58) HDAC1ACLYACMSDHNF4ADHFR

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
CN-102333757-B N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2014-11-26 CN disclosed
US-8492582-B2 N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2013-07-23 US disclosed
CN-102333757-A N-acyl anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2012-01-25 CN disclosed
US-20110275797-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2011-11-10 US disclosed
EP-2385036-A1 N-ACYL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2011-11-09 EP 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 73/4885ACLY 295/4885ACMSD 74/4885

“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.