SCHEMBL918437

SCHEMBL918437

CCCCCCCCCCCCNC(CCN)C(CCN)NCCCCCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RRM1 P23921 1/20 0.49
DPP7 Q9UHL4 1/20 0.46
DNM1 Q05193 8/20 0.44
ALDH1A1 P00352 2/20 0.44
EPHX1 P07099 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 1/20 0.44
GNAI3 P08754 1/20 0.42
GNAO1 P09471 1/20 0.42
GNAI1 P63096 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL11775651 0.83 RRM1 (0.49) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL8166834 0.83 RRM1 (0.49) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL2241685 0.81 RRM1 (0.47) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL28548753 0.81 RRM1 (0.51) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL27533018 0.81 RRM1 (0.51) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL29002310 0.81 RRM1 (0.51) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL3311312 0.81 RRM1 (0.51) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL6481169 0.81 RRM1 (0.47) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL29002293 0.81 RRM1 (0.51) RRM1DPP7DNM1ALDH1A1EPHX1
SCHEMBL10918368 0.79 RRM1 (0.46) RRM1DPP7DNM1ALDH1A1EPHX1

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
US-20110021675-A1 DISPERSING AGENT, AND PIGMENT COMPOSITION, PIGMENT-DISPERSED PRODUCT AND INKJET INK PREPARED THEREFROM TOYO INK MANUFACTURING CO., LTD. (JP) 2011-01-27 US disclosed
EP-2269719-A1 DISPERSANT AND PIGMENT COMPOSITION, PIGMENT DISPERSING SUBSTANCE, AND INKJET INK USING THE DISPERSANT Toyo Ink Manufacturing CO., LTD. (JP) 2011-01-05 EP disclosed