SCHEMBL8095039

SCHEMBL8095039

CCCCCCC(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.60
CNR2 P34972 1/20 0.46
DNM1 Q05193 2/20 0.46
MMP2 P08253 9/20 0.45
MMP1 P03956 4/20 0.45
MMP3 P08254 4/20 0.45
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EPHX2 P34913 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL8094019 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8094075 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8094331 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8093624 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8100368 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8093074 1.00 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL8093653 0.98 CSNK1E (0.57) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL30903825 0.96 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL29199074 0.96 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1
SCHEMBL22806767 0.96 CSNK1E (0.60) CSNK1ECNR2DNM1MMP2MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed