SCHEMBL6109095

SCHEMBL6109095

O=C(O)CCCN1CCC(CNc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 19/20 0.55
▸ KCNH2 Q12809 2/20 0.50
▸ F2 P00734 1/20 0.47

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
SCHEMBL6110321 0.95 F10 (0.56) F10KCNH2F2
SCHEMBL6106760 0.91 F10 (0.53) F10KCNH2F2
SCHEMBL6107076 0.90 F10 (0.59) F10KCNH2
SCHEMBL7365174 0.90 F10 (0.54) F10KCNH2F2
SCHEMBL6108251 0.89 F10 (0.57) F10F2
SCHEMBL6107033 0.87 F10 (0.54) F10KCNH2F2
SCHEMBL6110035 0.86 F10 (0.54) F10F2
SCHEMBL6107282 0.84 F10 (0.58) F10F2
SCHEMBL6106774 0.84 F10 (0.49) F10KCNH2F2
SCHEMBL6107182 0.83 F10 (0.56) F10KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129245-B2 Anticoagulants which act selectively on factor Xa; fast acting; oral; do not interfere with lysis of blood clots ELI LILLY AND COMPANY (US) 2006-10-31 — — US disclosed
Send feedback