SCHEMBL4483146

SCHEMBL4483146

CCN(C(=O)c1ccc(C(=O)O)cn1)N(C(C)C)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 6/20 0.50
P4HA1 P13674 2/20 0.50
MIF P14174 1/20 0.50
HCAR3 P49019 12/20 0.46
MAPT P10636 1/20 0.43
HCAR2 Q8TDS4 2/20 0.43
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4481417 0.85 MAPK1 (0.56) P4HTMMAPTKDM4EMAPK1L3MBTL1
SCHEMBL840870 0.74 P4HTM (0.53) P4HTMP4HA1MIFHCAR3MAPT
SCHEMBL22060647 0.74 P4HTM (0.66) P4HTMP4HA1MIFHCAR3MAPT
SCHEMBL211416 0.74 P4HTM (0.66) P4HTMP4HA1MIFHCAR3MAPT
SCHEMBL14809913 0.74 P4HTM (0.56) P4HTMP4HA1MIFHCAR3MAPT
SCHEMBL840867 0.74 HCAR3 (0.59) P4HTMP4HA1MIFHCAR3MAPT
Pyridine-2,5-Dicarboxylic Acid SCHEMBL70231 0.69 P4HTM (1.00) P4HTMP4HA1MIFHCAR3KDM4E
Pyridine-2,5-Dicarboxylic Acid SCHEMBL29363410 0.69 P4HTM (1.00) P4HTMP4HA1MIFHCAR3KDM4E
SCHEMBL28630671 0.69 P4HTM (0.58) P4HTMP4HA1MIFHCAR3MAPT
SCHEMBL7276744 0.68 P4HA1 (0.61) P4HTMP4HA1MIFHCAR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7501451-B2 Mono-acylated o-phenylendiamines derivatives HOFFMANN-LA ROCHE INC. (US) 2009-03-10 US disclosed
US-7071219-B2 Mono-acylated o-phenylendiamines derivatives HOFFMANN-LA ROCHE INC. (US) 2006-07-04 US disclosed
US-20060089403-A1 Mono-acylated o-phenylendiamines derivatives FERTIG GEORG 2006-04-27 US disclosed
EP-1592667-A2 NEW MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-11-09 EP disclosed
WO-2004069803-A2 MONO-ACYLATED O-PHENYLENDIAMINES DERIVATIVES AND THEIR USE AGAINST CANCER F. HOFFMANN-LA ROCHE AG (CH) 2004-08-19 WO disclosed
US-20040162317-A1 Mono-acylated o-phenylendiamines derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2004-08-19 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-20060089403-A1 Mono-acylated o-phenylendiamines derivatives HDAC1, HDAC10, HDAC11 P4HTM 692/4885P4HA1 232/4885MIF 4459/4885
US-20040162317-A1 Mono-acylated o-phenylendiamines derivatives HDAC1, HDAC11, HDAC10 P4HTM 1825/4885P4HA1 343/4885MIF 4715/4885

“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.