SCHEMBL20869748

SCHEMBL20869748

NCCCCCCCCCCI

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.61
CA12 O43570 2/20 0.61
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CA3 P07451 2/20 0.61
CA4 P22748 2/20 0.61
CA6 P23280 2/20 0.61
CA5A P35218 2/20 0.61
CA7 P43166 2/20 0.61
CA9 Q16790 2/20 0.61
CA14 Q9ULX7 2/20 0.61
CA5B Q9Y2D0 2/20 0.61
TSHR P16473 2/20 0.61
LMNA P02545 1/20 0.61
BLM P54132 1/20 0.61
NFKB1 P19838 1/20 0.54
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
EPHX1 P07099 1/20 0.44

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
SCHEMBL8737675 1.00
SCHEMBL21334359 1.00
SCHEMBL13972062 1.00 DNM1 (0.61) DNM1CA12CA1CA2CA3
SCHEMBL7530893 1.00 DNM1 (0.61) DNM1CA12CA1CA2CA3
SCHEMBL9226609 1.00
SCHEMBL15468548 1.00 DNM1 (0.61) DNM1CA12CA1CA2CA3
SCHEMBL2228163 1.00 DNM1 (0.61) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL7528287 0.96 DNM1 (0.57) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL4962793 0.96
Iodide SCHEMBL7533245 0.96 DNM1 (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114956173-B Dodecyl amine modified V 2 O 5 Material, preparation method thereof and application of material as supercapacitor electrode material 辽宁大学 2023-12-29 CN disclosed
US-11058796-B2 Method and apparatus for treating bone fractures, and/or for fortifying and/or augmenting bone, including the provision and use of composite implants, and novel composite structures which may be used for medical and non-medical applications 206 ORTHO, INC. (US) 2021-07-13 US disclosed
US-20190101545-A1 Novel Rotaxane-Type Probe For Molecular Imaging UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES 2019-04-04 US disclosed