SCHEMBL4059409

SCHEMBL4059409

CCCCC(N)(CCCC)CCCCCCCN

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TSHR P16473 1/20 0.57
EPHX1 P07099 1/20 0.57
FDPS P14324 3/20 0.43
SMPD1 P17405 2/20 0.43
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 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
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA5B Q9Y2D0 2/20 0.40

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
SCHEMBL1900711 1.00 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL16827196 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1785589 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1782324 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1782745 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL23576181 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL27755113 0.95 DNM1 (0.65) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1784340 0.90 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4460210 0.90 DNM1 (0.50) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1783973 0.90 DNM1 (0.57) DNM1MEN1KMT2AALDH1A1TSHR

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-2078048-A1 DIAMINE CHAIN EXTENDER COMPOSITIONS Albemarle Corporation (US) 2009-07-15 EP disclosed
WO-2008039571-A1 DIAMINE CHAIN EXTENDER COMPOSITIONS ALBEMARLE CORPORATION (US) 2008-04-03 WO disclosed