SCHEMBL13869882

SCHEMBL13869882

C=CCN(CC=C)CCCOc1ccc2nc(-c3n[nH]c4ccsc34)[nH]c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.43
FLT1 P17948 1/20 0.43
LSS P48449 1/20 0.40
FLT3 P36888 2/20 0.38
ACHE P22303 5/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36
CHEK2 O96017 3/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34

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
SCHEMBL1621279 0.84 ITK (0.48) LSSFLT3KDM4E
SCHEMBL1622372 0.77 FGFR1 (0.69) FGFR1FLT1ACHECHEK2HRH4
SCHEMBL13869880 0.76 FGFR1 (0.61) FGFR1FLT1ACHECHEK2HRH4
SCHEMBL1622615 0.76 NPC1 (0.52) FGFR1FLT3KDM4ENPC1ALDH1A1
SCHEMBL13869874 0.74 FGFR1 (0.58) FGFR1FLT1ACHECHEK2HRH4
SCHEMBL1623510 0.72 ITK (0.55) FLT3ATP4AATP4BKDM4ELMNA
SCHEMBL13869876 0.71 FGFR1 (0.55) FGFR1FLT1ACHECHEK2HRH4
SCHEMBL1622165 0.69 ITK (0.54) FLT3
SCHEMBL1622563 0.67 FGFR1 (0.61) FGFR1FLT1KDM4ENPC1USP2
SCHEMBL21017785 0.66 ACHE (0.73) ACHEATP4AATP4BCHEK2KDM4E

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-7518000-B2 Thienopyrazoles AVENTIS PHARMACEUTICALS, INC. (US) 2009-04-14 US disclosed
US-7518000-B2 Thienopyrazoles AVENTIS PHARMACEUTICALS, INC. (US) 2009-04-14 US disclosed
US-20070254937-A1 Thienopyrazoles AVENTIS PHARMACEUTICALS INC. (US) 2007-11-01 US disclosed
US-20070254937-A1 Thienopyrazoles AVENTIS PHARMACEUTICALS INC. (US) 2007-11-01 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 (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-20070254937-A1 Thienopyrazoles ITK, IL2, JAK2 FGFR1 846/4885FLT1 1207/4885LSS 1631/4885

“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.