SCHEMBL6933261

SCHEMBL6933261

CC(C)(N)C(C)(C)C(C)(C)CCCCCCCCCN

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38
BLM P54132 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
EPHX1 P07099 1/20 0.36
FDPS P14324 1/20 0.34

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
SCHEMBL6931791 1.00 DNM1 (0.38) DNM1CA12CA1CA2CA3
Bromide SCHEMBL28376789 0.98 DNM1 (0.39) DNM1CA12CA1CA2CA3
SCHEMBL1726666 0.90 ODC1 (0.31) FDPSNFKB1
Bromide SCHEMBL789378 0.88 DNM1 (0.31) DNM1
Water SCHEMBL1725502 0.88 ODC1 (0.30)
Hydrochloric Acid SCHEMBL18420902 0.88 KDM4E (0.32) DNM1LMNABLM
SCHEMBL11043290 0.86 DNM1 (0.38) DNM1CA12CA1CA2CA3
SCHEMBL1978386 0.85 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL184649 0.85 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL2879557 0.85 DNM1 (0.42) DNM1CA12CA1CA2CA3

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-1088791-B1 Process for the preparation of MTT-type zeolites using specific structuring agent precursors INST FRANCAIS DU PETROLE (FR) 2003-11-26 EP disclosed
EP-1088791-A1 Process for the preparation of MTT-type zeolites using specific structuring agent precursors INSTITUT FRANCAIS DU PETROLE (FR) 2001-04-04 EP disclosed