SCHEMBL5608084

SCHEMBL5608084

CCCOC(=O)C1=CC2CCC1C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ESR1 P03372 1/20 0.39
CHRM1 P11229 1/20 0.39
SLC6A2 P23975 1/20 0.39
KDR P35968 1/20 0.39
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
STS P08842 1/20 0.36
CYP19A1 P11511 1/20 0.35
HPGD P15428 2/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
PLAT P00750 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL30612333 0.91 TSHR (0.44) ALDH1A1LMNATSHRTDP1ESR1
SCHEMBL2350191 0.91 TSHR (0.44) ALDH1A1LMNATSHRTDP1ESR1
SCHEMBL10593447 0.88 ALDH1A1 (0.47) ALDH1A1LMNATSHRESR1RAB9A
SCHEMBL4247813 0.87 TSHR (0.38) ALDH1A1LMNATSHRESR1RAB9A
SCHEMBL28515052 0.87 TSHR (0.38) ALDH1A1LMNATSHRESR1RAB9A
SCHEMBL7568323 0.87 ALDH1A1 (0.39) ALDH1A1LMNATSHRRAB9ASMN1; SMN2
SCHEMBL4331067 0.86 TSHR (0.40) ALDH1A1LMNATSHRTDP1ESR1
SCHEMBL4852053 0.86 TSHR (0.40) ALDH1A1LMNATSHRTDP1ESR1
SCHEMBL513140 0.86 CYP19A1 (0.39) ALDH1A1TSHRSLC6A2CYP19A1HPGD
SCHEMBL4851503 0.83 TSHR (0.38) ALDH1A1LMNATSHRTDP1ESR1

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-1791888-A1 POLYCYCLOOLEFIN POLYMERIC COMPOSITIONS FOR SEMICONDUCTOR APPLICATIONS Promerus, LLC (US) 2007-06-06 EP disclosed
WO-2006023511-A1 POLYCYCLOOLEFIN POLYMERIC COMPOSITIONS FOR SEMICONDUCTOR APPLICATIONS PROMERUS LLC (US) 2006-03-02 WO disclosed