SCHEMBL27720164

SCHEMBL27720164

CCCN(N)CCCN(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.48
ALDH1A1 P00352 4/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 3/20 0.34
CTH P32929 1/20 0.34
CYP1A2 P05177 2/20 0.32
HRH4 Q9H3N8 2/20 0.32
CYP2D6 P10635 1/20 0.32
HRH2 P25021 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA3 P07451 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL7104677 0.89 ALDH1A1 (0.53) DNM1ALDH1A1TSHRTDP1CTH
SCHEMBL10436392 0.80
SCHEMBL1793896 0.80
SCHEMBL48384 0.80
SCHEMBL25134981 0.79
SCHEMBL19751429 0.78 DNM1 (0.46) DNM1ALDH1A1TSHRCA12CA2
Hydrochloric Acid SCHEMBL28738349 0.76
SCHEMBL10754292 0.76 DNM1 (0.50) DNM1ALDH1A1TSHRCA12CA2
SCHEMBL1576769 0.76 DNM1 (0.50) DNM1ALDH1A1TSHRCA12CA2
SCHEMBL15033222 0.76 DNM1 (0.50) DNM1ALDH1A1TSHRCA12CA2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108367992-A Reactive resin composition, multicomponent system and use thereof 喜利得股份公司 2018-08-03 CN disclosed
CN-105358646-B Reacting resin composition and application thereof 喜利得股份公司 2018-03-13 CN disclosed
CN-105377937-B The purposes of multicomponent mortar based on epoxides amine 喜利得股份公司 2018-03-02 CN disclosed
CN-107108840-A Reacting resin composition and application thereof 喜利得股份公司 2017-08-29 CN disclosed
CN-105377937-A Use of an epoxide amine-based multicomponent mortar composition HILTI AG 2016-03-02 CN disclosed
CN-105358646-A Reaction resin composition and use thereof HILTI AG 2016-02-24 CN disclosed
CN-101374879-B Curable composition HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2011-11-30 CN disclosed
CN-101374879-A Curable composition HUNTSMAN ADV MAT SWITZERLAND (CH) 2009-02-25 CN disclosed
CN-101305063-A Epoxy resin based coatings PPG BV (NL) 2008-11-12 CN disclosed