SCHEMBL1481407

SCHEMBL1481407

CCCCOc1ccc(/C=C/c2nc(-c3ccc(Cl)cc3Cl)cn2CCCC)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 5/20 0.45
ATP4B P51164 5/20 0.45
AHR P35869 1/20 0.40
CNR1 P21554 3/20 0.39
PDGFRB P09619 1/20 0.39
TLR8 Q9NR97 2/20 0.38
PPARA Q07869 1/20 0.36
PDE2A O00408 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL1481410 1.00 ATP4A (0.45) ATP4AATP4BAHRCNR1PDGFRB
SCHEMBL1481743 0.92 TLR8 (0.43) ATP4AATP4BAHRTLR8LMNA
SCHEMBL1481741 0.92 TLR8 (0.43) ATP4AATP4BAHRTLR8LMNA
SCHEMBL1480840 0.90 FFAR1 (0.42) ATP4AATP4BCNR1PPARA
SCHEMBL1480837 0.90 FFAR1 (0.42) ATP4AATP4BCNR1PPARA
SCHEMBL1481899 0.89 TLR8 (0.43) AHRCNR1TLR8LMNAMAPT
SCHEMBL1481901 0.89 TLR8 (0.43) AHRCNR1TLR8LMNAMAPT
SCHEMBL1480972 0.86 TLR8 (0.42) TLR8LMNAMAPTTP53SMN1; SMN2
SCHEMBL1480970 0.86 TLR8 (0.42) TLR8LMNAMAPTTP53SMN1; SMN2
SCHEMBL1481578 0.84 PPARA (0.41) PPARA

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 4 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-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
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 ATP4A 2140/4885ATP4B 2971/4885AHR 1771/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ ATP4A 2140/4885ATP4B 2971/4885AHR 1771/4885

“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.