SCHEMBL1481925

SCHEMBL1481925

Oc1ccc(-c2cccc(/C=C/c3nc(-c4ccc(Cl)cc4Cl)c[nH]3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.45
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
RELA Q04206 1/20 0.35
GFER P55789 1/20 0.35
BACE1 P56817 1/20 0.35
KCNA3 P22001 1/20 0.34
MAPK1 P28482 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CHEK1 O14757 1/20 0.33
ESR1 P03372 1/20 0.33
NPC1 O15118 2/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL1481927 1.00 MEN1 (0.45) MEN1KMT2ASMN1; SMN2MAPTHDAC2
SCHEMBL1481885 0.90 SMN1; SMN2 (0.49) MEN1KMT2ASMN1; SMN2MAPTBACE1
SCHEMBL1481883 0.90 SMN1; SMN2 (0.49) MEN1KMT2ASMN1; SMN2MAPTBACE1
SCHEMBL1482814 0.86 MEN1 (0.46) MEN1KMT2ASMN1; SMN2MAPTRELA
SCHEMBL1482813 0.86 MEN1 (0.46) MEN1KMT2ASMN1; SMN2MAPTRELA
SCHEMBL1480766 0.84 PTGES (0.44) MEN1KMT2ASMN1; SMN2MAPTBACE1
SCHEMBL1480764 0.84 PTGES (0.44) MEN1KMT2ASMN1; SMN2MAPTBACE1
SCHEMBL6462917 0.82 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2MAPTBACE1
SCHEMBL1481354 0.81 TUBB4A (0.46) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL1481357 0.81 TUBB4A (0.46) MEN1KMT2ASMN1; SMN2MAPTMAPK1

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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 US disclosed
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
EP-1730118-A1 SUBSTITUTED AZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE Transtech Pharma, Inc. (US) 2006-12-13 EP disclosed
WO-2005080346-A1 SUBSTITUTED AZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-09-01 WO disclosed
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use TRANSTECH PHARMA, INC. 2005-08-25 US disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 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 (4 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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ MEN1 3467/4885KMT2A 1996/4885SMN1; SMN2 4575/4885
US-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use PTPRO, PTPN5, PTPRE MEN1 2851/4885KMT2A 2145/4885SMN1; SMN2 4417/4885
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use PTPRO, PTPN5, PTPRE MEN1 2851/4885KMT2A 2145/4885SMN1; SMN2 4417/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ MEN1 3467/4885KMT2A 1996/4885SMN1; SMN2 4575/4885

“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.