SCHEMBL5200019

SCHEMBL5200019

CCCCCCN(C(=N)NC(=N)Nc1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CNR2 P34972 2/20 0.40
ALDH1A1 P00352 2/20 0.39
PTBP1 P26599 1/20 0.39
CCKBR P32239 2/20 0.39
NPC1 O15118 1/20 0.39
JAK2 O60674 1/20 0.39
RAB9A P51151 1/20 0.39
PAX8 Q06710 1/20 0.39
KCNH2 Q12809 3/20 0.37
ADRB2 P07550 1/20 0.37
SLC6A3 Q01959 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL11191152 0.83 NPC1 (0.41) SMN1; SMN2CNR2ALDH1A1NPC1JAK2
SCHEMBL13583997 0.79 SLC6A3 (0.41) LMNASMN1; SMN2ALDH1A1NPC1PAX8
SCHEMBL3025013 0.76 SIGMAR1 (0.36) LMNAALDH1A1SLC6A3MEN1KMT2A
4-Chlorophenylbiguanide SCHEMBL3357690 0.76 LMNA (0.48) LMNASMN1; SMN2CNR2ALDH1A1PTBP1
SCHEMBL5144850 0.76 NPC1 (0.46) CNR2ALDH1A1NPC1JAK2RAB9A
SCHEMBL1171548 0.75 CNR2 (0.45) LMNASMN1; SMN2CNR2ALDH1A1PTBP1
SCHEMBL12522772 0.75 LMNA (0.55) LMNASMN1; SMN2ALDH1A1
Chlorhexidine SCHEMBL21680261 0.75 LMNA (0.55) LMNASMN1; SMN2ALDH1A1
SCHEMBL3826641 0.75 LMNA (0.55) LMNASMN1; SMN2ALDH1A1
SCHEMBL13585147 0.75 GAA (0.44) LMNASMN1; SMN2ALDH1A1PTBP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1841402-A1 PROCESS FOR PREPARING HYDROCOLLOIDS Lubrizol Advanced Materials, Inc. (US) 2007-10-10 EP disclosed
WO-2006065469-A1 PROCESS FOR PREPARING HYDROCOLLOIDS NOVEON, INC. (US) 2006-06-22 WO disclosed
WO-2006062792-A2 HYDROCOLLOIDS AND PROCESS THEREFOR NOVEON, INC. (US) 2006-06-15 WO disclosed
US-4704212-A SOFTENING, NEUTRALIZATION, DECHLORINATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1987-11-03 US disclosed