SCHEMBL5082545

SCHEMBL5082545

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.42
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
MGLL Q99685 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
GBA1 P04062 1/20 0.32
KCNH2 Q12809 3/20 0.32
CNR2 P34972 1/20 0.31

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
SCHEMBL5088802 1.00 DNM1 (0.42) DNM1TSHRTHRBMGLLCA12
SCHEMBL21519592 1.00 DNM1 (0.42) DNM1TSHRTHRBMGLLCA12
SCHEMBL29002046 1.00 DNM1 (0.42) DNM1TSHRTHRBMGLLCA12
SCHEMBL3978473 1.00 DNM1 (0.42) DNM1TSHRTHRBMGLLCA12
SCHEMBL5716608 0.98 DNM1 (0.41) DNM1TSHRTHRBMGLLCA12
Hydrochloric Acid SCHEMBL29002048 0.98 DNM1 (0.44) DNM1TSHRTHRBMGLLCA12
SCHEMBL5715545 0.96 DNM1 (0.39) DNM1TSHRTHRBMGLLCA12
SCHEMBL5716286 0.96 DNM1 (0.39) DNM1TSHRTHRBMGLLCA12
SCHEMBL6792563 0.91 DNM1 (0.39) DNM1TSHRTHRBMGLLCA12
SCHEMBL5716523 0.90 DNM1 (0.35) DNM1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487886-B1 SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2008-08-06 EP claimed
EP-1497301-B1 SUBSTITUTED POLYCYCLIC, FUSED RING METAL COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2006-11-29 EP claimed