SCHEMBL8768445

SCHEMBL8768445

C1CCCCCC(C(C2CCCCCCCCCCC2)C(C2CCCCCCCCCCC2)C2CCCCCCCCCCC2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.45
SHBG P04278 1/20 0.45
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TP53 P04637 2/20 0.41
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GMNN O75496 1/20 0.39
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2D6 P10635 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
MLNR O43193 1/20 0.39
ABCB11 O95342 1/20 0.39
EGFR P00533 1/20 0.39

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
SCHEMBL6520339 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL3000332 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL6527173 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL261328 0.79 EPHX1 (0.43) EPHX1SHBGTP53LMNAKDM4E
SCHEMBL6524219 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL6526132 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL6520191 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL9237351 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL19332953 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53
SCHEMBL6525332 0.79 SHBG (0.43) EPHX1SHBGALDH1A1HSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480447-B1 DCPD polymerization compositions HERCULES INC (US) 1997-08-27 EP claimed
US-5319042-A Feed composition of tungsten complex metathesis catalyst, dicyclopentadiene, catalyst activator HERCULES INCORPORATED (US) 1994-06-07 US claimed
EP-0480447-A2 Pure tungsten oxyphenolate complexes as DCPD polymerization catalysts HERCULES INCORPORATED (US) 1992-04-15 EP claimed
US-20140194576-A1 RUBBER COMPOSITION, CROSSLINKED RUBBER COMPOSITION, PNEUMATIC TIRE, AND METHOD FOR PRODUCING ISOBUTYLENE POLYMER JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-07-10 US disclosed
EP-2733172-A1 RUBBER COMPOSITION, CROSSLINKED RUBBER COMPOSITION, PNEUMATIC TIRE, AND METHOD FOR PRODUCING ISOBUTYLENE POLYMER JX Nippon Oil & Energy Corporation (JP) 2014-05-21 EP disclosed
US-5319042-A Feed composition of tungsten complex metathesis catalyst, dicyclopentadiene, catalyst activator HERCULES INCORPORATED (US) 1994-06-07 US disclosed
US-5298471-A Catalyst activator selected from organoaluminum, tin, silane, zinc or lead compounds HERCULES INCORPORATED (US) 1994-03-29 US disclosed
EP-0480447-A2 Pure tungsten oxyphenolate complexes as DCPD polymerization catalysts HERCULES INCORPORATED (US) 1992-04-15 EP disclosed