SCHEMBL20145349

SCHEMBL20145349

C#CC(C)CCCCCCN

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
TRPV1 Q8NER1 1/20 0.36

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
SCHEMBL19272856 0.98
SCHEMBL30572137 0.78 OPRM1 (0.44) DNM1TSHRLMNA
SCHEMBL30537662 0.78 OPRM1 (0.44) DNM1TSHRLMNA
SCHEMBL3532757 0.78 OPRM1 (0.44) DNM1TSHRLMNA
SCHEMBL313412 0.78 OPRM1 (0.44) DNM1TSHRLMNA
SCHEMBL28842995 0.78 OPRM1 (0.44) DNM1TSHRLMNA
SCHEMBL2118126 0.76
SCHEMBL6154173 0.76 TSHR (0.46) DNM1CA12CA1CA2CA3
SCHEMBL6154130 0.76 TSHR (0.46) DNM1CA12CA1CA2CA3
SCHEMBL11580737 0.75

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
EP-3112178-B1 ON-MACHINE DEVELOPMENT TYPE LITHOGRAPHIC PRINTING PLATE PRECURSOR PROCESSING METHOD AND PRINTING METHOD FUJIFILM CORP (JP) 2018-05-16 EP disclosed