SCHEMBL9664618

SCHEMBL9664618

O=C(NCCCl)n1cc(F)c(=O)[nH]c1=O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
MAPK3 P27361 1/20 0.67
ASAH1 Q13510 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
SQOR Q9Y6N5 1/20 0.67

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
SCHEMBL17278298 0.87 LMNA (0.69) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL11601229 0.85 ASAH1 (0.80) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL10459087 0.83 ASAH1 (0.72) LMNACYP3A4CYP2D6MAPK3ASAH1
Hydrochloric Acid SCHEMBL11253098 0.83 LMNA (0.72) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL10458638 0.83 ASAH1 (0.90) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL11251920 0.83 LMNA (0.68) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL10756987 0.83 LMNA (0.68) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL11603162 0.82 ASAH1 (0.97) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL17899487 0.82 LMNA (0.67) LMNACYP3A4CYP2D6MAPK3ASAH1
SCHEMBL11239635 0.82 LMNA (0.70) LMNACYP3A4CYP2D6MAPK3ASAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240352-B1 5-FLUOROURACIL DERIVATIVES AND PROCESSES FOR PRODUCING THEREOF Chisso Corporation (JP) 1992-12-16 EP disclosed
US-4792607-A ANTICANCER MEDICINE INTERRMEDIATES CHISSO CORPORATION (JP) 1988-12-20 US disclosed
EP-0240352-A2 5-Fluorouracil derivatives and processes for producing thereof Chisso Corporation (JP) 1987-10-07 EP disclosed