SCHEMBL28037204

SCHEMBL28037204

CCCCCCCCCOC(C)CCC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.48
EPHX2 P34913 1/20 0.38
THRB P10828 2/20 0.38
TSHR P16473 1/20 0.38
OPRM1 P35372 1/20 0.37
LPAR1 Q92633 4/20 0.37
LPAR3 Q9UBY5 4/20 0.37
LPAR2 Q9HBW0 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL28324991 1.00 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL28242336 1.00 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL12079040 1.00 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL20307406 1.00 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL12080582 1.00 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL9012377 0.98 DNM1 (0.45) DNM1EPHX2TSHROPRM1LPAR1
SCHEMBL17743222 0.98 DNM1 (0.45) DNM1EPHX2TSHROPRM1LPAR1
SCHEMBL3039218 0.91 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL7082641 0.91 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1
SCHEMBL17253503 0.91 DNM1 (0.48) DNM1EPHX2THRBTSHROPRM1

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-105026538-A Aqueous formulations, their preparation and their use in the cleaning of hard surfaces BASF SE 2015-11-04 CN disclosed