SCHEMBL8081402

SCHEMBL8081402

[CH2]C(N)OCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.54
CA1 P00915 8/20 0.40
CA2 P00918 8/20 0.40
CA9 Q16790 7/20 0.40
CA12 O43570 3/20 0.40
CA7 P43166 3/20 0.40
CA14 Q9ULX7 3/20 0.40
CA3 P07451 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
HTT P42858 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
OPRM1 P35372 1/20 0.37
LPAR1 Q92633 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
LPAR3 Q9UBY5 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
SCHEMBL8078335 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8083521 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8069185 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8081372 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8078540 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8078380 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8081447 1.00 DNM1 (0.54) DNM1CA1CA2CA9CA12
SCHEMBL8081463 0.98
SCHEMBL8083306 0.90
SCHEMBL7212928 0.80 DNM1 (0.58) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846679-B1 Process for preparing 1,3-disubstituted urea SUMIKA FINE CHEMICALS CO LTD (JP) 2000-09-06 EP disclosed
US-5902899-A Process for preparing 1, 3-disubstituted urea SUMIKA FINE CHEMICALS CO., LTD. (JP) 1999-05-11 US disclosed
EP-0846679-A2 Process for preparing 1,3-disubstituted urea SUMIKA FINE CHEMICALS Co., Ltd. (JP) 1998-06-10 EP disclosed