SCHEMBL5586226

SCHEMBL5586226

CCCCCCCCCC([O])Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.57
CNR2 P34972 1/20 0.47
EPHX2 P34913 1/20 0.46
PKM P14618 1/20 0.46
MMP2 P08253 11/20 0.46
MMP1 P03956 6/20 0.46
MMP3 P08254 6/20 0.46
ALDH1A1 P00352 1/20 0.44
DNM1 Q05193 1/20 0.43
MMP7 P09237 2/20 0.43

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
SCHEMBL10821452 1.00 CSNK1E (0.57) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL8011984 1.00 CSNK1E (0.57) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL5903351 0.92 CNR2 (0.47) CSNK1ECNR2
SCHEMBL9641434 0.84 SIGMAR1 (0.46) CSNK1E
SCHEMBL28523845 0.81 CSNK1E (0.57) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL1678339 0.81 KCNH2 (0.53) CNR2ALDH1A1
SCHEMBL8094331 0.81 CSNK1E (0.60) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL8094075 0.81 CSNK1E (0.60) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL22806767 0.81 CSNK1E (0.60) CSNK1ECNR2EPHX2PKMMMP2
SCHEMBL8093074 0.81 CSNK1E (0.60) CSNK1ECNR2EPHX2PKMMMP2

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-1846160-A1 NOVEL MICROFLUIDIC SAMPLE HOLDER Backes, Perdita (DE) 2007-10-24 EP claimed
WO-2006069757-A1 NOVEL MICROFLUIDIC SAMPLE HOLDER BACKES PERDITA (DE) 2006-07-06 WO claimed
US-6117364-A COMPRISING CINNAMALDEHYDE AND SPECIFIED ORGANOSULFUR COMPOUND(S); FREE OF ALKYLPHENOL ETHOXY COMPOUNDS; DOES NOT HAVE OIL FIELD ALDEHYDE/POLYACRYLAMIDE CROSSLINKING INCOMPATIBILITY; FOR ACID STIMULATION OF WELLS NALCO/EXXON ENERGY CHEMICALS, L.P. (US) 2000-09-12 US disclosed