SCHEMBL20142348

SCHEMBL20142348

CCCCCCCCCCCCCCNC(CCN)CCCN

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RRM1 P23921 1/20 0.45
DNM1 Q05193 8/20 0.44
EPHX1 P07099 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 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
DPP7 Q9UHL4 1/20 0.42
SIRT6 Q8N6T7 1/20 0.39
SIRT1 Q96EB6 1/20 0.39

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
SCHEMBL28205624 1.00 RRM1 (0.45) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL31090424 0.94 GNAI3 (0.47) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL31090421 0.94 RRM1 (0.46) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL22205254 0.92 DNM1 (0.44) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL31090410 0.90 DNM1 (0.52) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL22205253 0.90 DNM1 (0.46) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL16389935 0.90 SLC6A5 (0.48) RRM1ALDH1A1
SCHEMBL16389934 0.90 SLC6A5 (0.48) RRM1ALDH1A1
SCHEMBL9171472 0.88 DNM1 (0.48) RRM1DNM1EPHX1MEN1KMT2A
SCHEMBL27603365 0.88 DNM1 (0.48) RRM1DNM1EPHX1MEN1KMT2A

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-3537877-A1 DISINFECTANT COMPOSITION HAVING RESIDUAL BIOCIDAL PROPERTIES Lonza Inc. (US) 2019-09-18 EP disclosed
WO-2018089761-A1 DISINFECTANT COMPOSITION HAVING RESIDUAL BIOCIDAL PROPERTIES LONZA INC. (US) 2018-05-17 WO disclosed