SCHEMBL347849

SCHEMBL347849

CCCCOc1cc2nccnc2cc1OCCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.45
CYP2C9 P11712 5/20 0.42
CYP2C19 P33261 5/20 0.42
CYP1A2 P05177 4/20 0.42
CYP2D6 P10635 4/20 0.41
CYP3A4 P08684 2/20 0.41
EGFR P00533 1/20 0.40
CYP19A1 P11511 4/20 0.40
ENPP1 P22413 1/20 0.39
PDE4A P27815 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4C Q08493 2/20 0.38
PDE4D Q08499 2/20 0.38
PDE5A O76074 1/20 0.38
MCHR1 Q99705 1/20 0.38
CDC7 O00311 1/20 0.37
ROCK2 O75116 1/20 0.37
MAP4K4 O95819 1/20 0.37
PIM1 P11309 1/20 0.37
PRKACA P17612 1/20 0.37

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
SCHEMBL13412631 0.81 CYP1A2 (0.52) TLR8CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL11475790 0.78 ENPP1 (0.46) TLR8CYP2C9CYP2C19CYP1A2EGFR
SCHEMBL30485171 0.77 CYP1A2 (0.48) TLR8CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL7755326 0.77 CYP1A2 (0.48) TLR8CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL30485172 0.77 CYP1A2 (0.48) TLR8CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL16070093 0.74 EHMT2 (0.50) TLR8ENPP1SRCPDE3BPDE3A
SCHEMBL2246934 0.74 TLR8 (0.50) TLR8CYP3A4PDE4APDE4BPDE4C
SCHEMBL6933511 0.74 TLR8 (0.50) TLR8CYP3A4PDE4APDE4BPDE4C
SCHEMBL28573341 0.74 PDE5A (0.45) TLR8CYP1A2CYP2D6CYP3A4PDE5A
SCHEMBL7739532 0.73 CYP1A2 (0.45) TLR8CYP2C9CYP2C19CYP1A2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
CN-101001900-B Process for producing aromatic compound polymer SUMITOMO CHEMICAL CO 2011-04-20 CN disclosed
CN-101914111-A The preparation method of aromatic compound polymer SUMITOMO CHEMICAL CO 2010-12-15 CN disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
CN-101001900-A Process for producing aromatic compound polymer SUMITOMO CHEMICAL CO (JP) 2007-07-18 CN disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP 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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR TLR8 2756/4885CYP2C9 166/4885CYP2C19 171/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR TLR8 2779/4885CYP2C9 159/4885CYP2C19 173/4885

“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.