SCHEMBL537019

SCHEMBL537019

[CH2]c1ccc(C(=O)Nc2ccccc2N)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 18/20 0.74
HDAC3 O15379 10/20 0.74
HDAC2 Q92769 10/20 0.74
MAPK1 P28482 1/20 0.74
NCOR2 Q9Y618 4/20 0.71
PTGS1 P23219 1/20 0.67
HDAC4 P56524 3/20 0.65
HDAC7 Q8WUI4 3/20 0.65
HDAC10 Q969S8 3/20 0.65
HDAC11 Q96DB2 3/20 0.65
HDAC8 Q9BY41 3/20 0.65
HDAC6 Q9UBN7 3/20 0.65
HDAC9 Q9UKV0 3/20 0.65
HDAC5 Q9UQL6 3/20 0.65
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57

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
SCHEMBL8401704 0.91 HDAC1 (0.89) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL4715033 0.87 HDAC1 (0.70) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL1060598 0.86 HDAC1 (0.79) HDAC1HDAC3HDAC2MAPK1NCOR2
Dinaline SCHEMBL93636 0.86 HDAC1 (0.79) HDAC1HDAC3HDAC2MAPK1NCOR2
Dinaline SCHEMBL29354254 0.86 HDAC1 (0.79) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL407834 0.85 HDAC1 (1.00) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL30363156 0.85 HDAC1 (1.00) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL23500754 0.84 HDAC1 (0.83) HDAC1HDAC3HDAC2MAPK1NCOR2
Dinaline SCHEMBL10373837 0.84 HDAC1 (0.77) HDAC1HDAC3HDAC2MAPK1NCOR2
SCHEMBL18361216 0.84 HDAC1 (0.77) HDAC1HDAC3HDAC2MAPK1NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105682655-A Antimicrobial compounds 阿克塞利亚制药公司 2016-06-15 CN claimed
CN-106966978-A A kind of amides compound and its production and use 北京化工大学 2017-07-21 CN disclosed
CN-105682655-A Antimicrobial compounds 阿克塞利亚制药公司 2016-06-15 CN disclosed
CN-104208716-A Cyclodextrin-based polymers for therapeutic delivery CERULEAN PHARMA INC 2014-12-17 CN disclosed
CN-103442563-A cancer treatment CERULEAN PHARMA INC 2013-12-11 CN disclosed
CN-102781237-A Cyclodextrin-based polymers for delivery of therapeutic agents CERULEAN PHARMA INC 2012-11-14 CN disclosed
EP-2413901-A1 POLYMER-AGENT CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE Cerulean Pharma Inc. (US) 2012-02-08 EP disclosed
WO-2010117668-A1 POLYMER-AGENT CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2010-10-14 WO disclosed
EP-1833500-A4 METHOD TO ENHANCE THE BONE FORMATION ACTIVITY OF BMP BY RUNX2 ACETYLATION BIORUNX CO LTD (KR) 2009-08-12 EP disclosed
US-20080219962-A1 Method to Enhance the Bone Formation Activity of Bmp by Runx2 Acetylation BIORUNX CO., LTD. (KR) 2008-09-11 US disclosed
EP-1833500-A1 METHOD TO ENHANCE THE BONE FORMATION ACTIVITY OF BMP BY RUNX2 ACETYLATION Biorunx Co., Ltd (KR) 2007-09-19 EP disclosed
WO-2006065075-A1 METHOD TO ENHANCE THE BONE FORMATION ACTIVITY OF BMP BY RUNX2 ACETYLATION BIORUNX CO. LTD. (KR) 2006-06-22 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-20080219962-A1 Method to Enhance the Bone Formation Activity of Bmp by Runx2 Acetylation BMP2, BMP1, BMP4 HDAC1 28/4885HDAC3 118/4885HDAC2 181/4885

“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.