SCHEMBL6057656

SCHEMBL6057656

[CH](CCCCC1CCCC1)CCCCC1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
CYP1A2 P05177 1/20 0.48
EPHX1 P07099 1/20 0.35
KDM5A P29375 3/20 0.34
PHF8 Q9UPP1 3/20 0.34
KDM2A Q9Y2K7 3/20 0.34
KDM4C Q9H3R0 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
KDM4A O75164 1/20 0.33
MAPT P10636 1/20 0.33
CEL P19835 1/20 0.33
SLC18A3 Q16572 1/20 0.32

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
SCHEMBL8837639 0.97 SIGMAR1 (0.54) SIGMAR1CYP1A2EPHX1KDM5APHF8
SCHEMBL7854963 0.93 SIGMAR1 (0.50) SIGMAR1CYP1A2EPHX1KDM5APHF8
SCHEMBL9242305 0.87 CYP1A2 (0.52) SIGMAR1CYP1A2EPHX1KDM5APHF8
SCHEMBL892110 0.87 CYP1A2 (0.65) SIGMAR1CYP1A2EPHX1
SCHEMBL891264 0.85 CYP1A2 (0.63) SIGMAR1CYP1A2EPHX1
SCHEMBL891947 0.85 CYP1A2 (0.63) SIGMAR1CYP1A2EPHX1
SCHEMBL6751554 0.85 CYP1A2 (0.63) SIGMAR1CYP1A2EPHX1
SCHEMBL9300758 0.85 CYP1A2 (0.63) SIGMAR1CYP1A2EPHX1
SCHEMBL8082086 0.85 CYP1A2 (0.50) SIGMAR1CYP1A2EPHX1KDM5APHF8
SCHEMBL4655177 0.83 SIGMAR1 (0.45) SIGMAR1CYP1A2EPHX1KDM5APHF8

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
US-7132499-B2 Polyester resin container with improved weatherability ASAHI DENKA CO., LTD. (JP) 2006-11-07 US disclosed
US-20050282995-A1 Polyester resin container with improved weatherability ASAHI DENKA CO., LTD. (JP) 2005-12-22 US disclosed