SCHEMBL3785500

SCHEMBL3785500

CCCCOc1ccc(OCCCC)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.59
GLA P06280 1/20 0.59
L3MBTL1 Q9Y468 4/20 0.55
TDP1 Q9NUW8 2/20 0.55
ALDH1A1 P00352 1/20 0.55
CSNK2A1 P68400 2/20 0.53
BACE1 P56817 1/20 0.52
KDM4E B2RXH2 1/20 0.51
ATM Q13315 2/20 0.51
MAPT P10636 3/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARA Q07869 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL19612183 0.95 SMN1; SMN2 (0.55) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL3787950 0.92 CSNK2A1 (0.62) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL11097969 0.86 MAPT (0.46) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL3790208 0.85 KDM4E (0.51) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL5477791 0.85 ALDH1A1 (0.68) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL12885024 0.84 KDM4E (0.69) SMN1; SMN2L3MBTL1ALDH1A1KDM4EATM
SCHEMBL13545909 0.83 PPARA (0.59) SMN1; SMN2GLACSNK2A1BACE1ATM
SCHEMBL12967963 0.83 L3MBTL1 (0.69) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL9433103 0.83 SMN1; SMN2 (0.58) SMN1; SMN2GLAL3MBTL1TDP1ALDH1A1
SCHEMBL11094999 0.82 CSNK2A1 (0.42) SMN1; SMN2GLAL3MBTL1TDP1CSNK2A1

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-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed
EP-0599886-A4 MACROMONOMERS HAVING REACTIVE END GROUPS. MAXDEM INC (US) 1996-07-24 EP disclosed
EP-0599886-A1 MACROMONOMERS HAVING REACTIVE END GROUPS MAXDEM INCORPORATED (US) 1994-06-08 EP disclosed
WO-1993004099-A1 MACROMONOMERS HAVING REACTIVE END GROUPS MAXDEM INCORPORATED (US) 1993-03-04 WO 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 SMN1; SMN2 4524/4885GLA 2514/4885L3MBTL1 3838/4885

“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.