SCHEMBL5708652

SCHEMBL5708652

C=C(C)C(N)=O.C=C(C)C(N)=O.C=C(C)C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 1.00
LMNA P02545 3/20 0.54
BLM P54132 2/20 0.54
ALOX15 P16050 1/20 0.54
PMP22 Q01453 1/20 0.54
ALDH1A1 P00352 4/20 0.42
LDHA P00338 2/20 0.40
LDHB P07195 1/20 0.40
OR51E2 Q9H255 1/20 0.39
HSD17B10 Q99714 1/20 0.37
CRBN Q96SW2 1/20 0.37
TSHR P16473 3/20 0.36
ACHE P22303 1/20 0.36
THPO P40225 1/20 0.36
FFAR3 O14843 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
FGFR4 P22455 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL14870 1.00
SCHEMBL2128293 1.00 TDP1 (1.00) TDP1LMNABLMALOX15PMP22
Bromide SCHEMBL270286 0.96
Hydrochloric Acid SCHEMBL160857 0.96
Water SCHEMBL11248400 0.96
Hydrogen Sulfide SCHEMBL8940298 0.96
Formaldehyde SCHEMBL1705724 0.96
SCHEMBL4561634 0.96
Ammonia Solution, Strong SCHEMBL21838781 0.96 TDP1 (0.92) TDP1LMNABLMALOX15PMP22
Methyl Alcohol SCHEMBL8853832 0.96

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-9622959-B2 Cross-linked polymere CLARIANT INTERNATIONAL LTD. (CH) 2017-04-18 US disclosed
US-20140127147-A1 Cross-linked Polymere CLARIANT FINANCE (BVI) LIMITED (VG) 2014-05-08 US disclosed
EP-0966488-B1 PROCESS FOR INTRODUCING A FUNCTIONALITY GE HEALTHCARE BIO SCIENCES AB (SE) 2006-10-11 EP disclosed
US-6426315-B1 Process for introducing a functionality AMERSHAM PHARMACIA BIOTECH AB (SE) 2002-07-30 US disclosed
EP-0966488-A1 PROCESS FOR INTRODUCING A FUNCTIONALITY Amersham Pharmacia Biotech AB (SE) 1999-12-29 EP disclosed
WO-1998039364-A1 PROCESS FOR INTRODUCING A FUNCTIONALITY AMERSHAM PHARMACIA BIOTECH AB (SE) 1998-09-11 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-20140127147-A1 Cross-linked Polymere PCNA, SMC2, SMC1A TDP1 929/4885LMNA 3609/4885BLM 1398/4885

“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.