SCHEMBL28878262

SCHEMBL28878262

CCCCCCOC(CC)OCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.52
CA1 P00915 8/20 0.43
CA2 P00918 8/20 0.43
CA9 Q16790 7/20 0.43
CA12 O43570 3/20 0.43
CA7 P43166 3/20 0.43
CA14 Q9ULX7 3/20 0.43
CA3 P07451 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA5B Q9Y2D0 2/20 0.43
TSHR P16473 2/20 0.42
THRB P10828 2/20 0.42
RECQL P46063 2/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
EPHX2 P34913 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL27058279 1.00 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL24562854 1.00 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL13038625 1.00 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL14836599 0.95 DNM1 (0.48) DNM1CA1CA2CA9CA12
SCHEMBL27835501 0.93 DNM1 (0.47) DNM1CA1CA2CA9CA12
SCHEMBL14836168 0.92 DNM1 (0.45) DNM1CA1CA2CA9CA12
SCHEMBL10004744 0.90 DNM1 (0.43) DNM1CA1CA2CA9CA12
SCHEMBL2311733 0.89 ADRB2 (0.41) DNM1CA1CA2CA9TSHR
SCHEMBL4926243 0.88 DNM1 (0.47) DNM1CA1CA2CA9CA12
SCHEMBL15384178 0.88 DNM1 (0.47) DNM1CA1CA2CA9CA12

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
CN-110520409-A Compounds and compositions for intracellular delivery of therapeutic agents MODERNATX INC 2019-11-29 CN disclosed