SCHEMBL6010130

SCHEMBL6010130

O=[C]c1ccc(-c2ccccc2Cl)o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RAB9A P51151 8/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
MAPT P10636 4/20 0.45
MAPK1 P28482 3/20 0.45
LMNA P02545 2/20 0.45
SLC9A1 P19634 1/20 0.45
CASP3 P42574 1/20 0.45
RECQL P46063 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
NPC1 O15118 5/20 0.44
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
HPGD P15428 5/20 0.42
HTT P42858 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 3/20 0.42

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
SCHEMBL2324496 0.79 MAPT (0.46) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL6009742 0.73 MEN1 (0.45) MEN1KMT2ASMN1; SMN2HTTKDM4E
SCHEMBL2322196 0.73 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL2346044 0.72 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL2322765 0.71 SLC9A1 (0.48) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL1616485 0.71 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL5543164 0.71 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL1616299 0.70 KDM4E (0.58) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL27703403 0.70 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ANPSR1RAB9A
SCHEMBL6010443 0.70 SLC9A1 (0.52) ALDH1A1MEN1KMT2AMAPTLMNA

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-1697335-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-09-06 EP disclosed
WO-2005063727-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-07-14 WO disclosed