SCHEMBL1481046

SCHEMBL1481046

N#Cc1ccc(-c2c[nH]c(/C=C/c3ccc(Br)cc3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.39
MAPT P10636 5/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
GPR183 P32249 1/20 0.36
AHR P35869 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
KDM1A O60341 2/20 0.34
FBP1 P09467 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
SCHEMBL1481048 1.00 HDAC2 (0.39) HDAC2MAPTKMT2AGAAKDM4E
SCHEMBL1481844 0.82 MAPT (0.43) HDAC2MAPTKMT2AGAAKDM4E
SCHEMBL1481845 0.82 MAPT (0.43) HDAC2MAPTKMT2AGAAKDM4E
SCHEMBL1676998 0.82 NPC1 (0.48) MAPTKMT2AGAAKDM4EALDH1A1
SCHEMBL1676996 0.82 NPC1 (0.48) MAPTKMT2AGAAKDM4EALDH1A1
SCHEMBL1481565 0.79 MAPT (0.50) MAPTKMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL1481561 0.79 MAPT (0.50) MAPTKMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL1480689 0.79 TRPV1 (0.40) MAPTKMT2AKDM4EALDH1A1GPR183
SCHEMBL1481729 0.79 ERBB2 (0.41) KDM4EGPR183AHRERBB2
SCHEMBL1480924 0.79 MAPT (0.50) MAPTKMT2AKDM4EMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 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 (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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ HDAC2 2979/4885MAPT 3558/4885KMT2A 1996/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ HDAC2 2979/4885MAPT 3558/4885KMT2A 1996/4885

“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.