SCHEMBL7928607

SCHEMBL7928607

CC1=C([Ti](OC(=O)C2CCCCC2)(OC(=O)C2CCCCC2)OC(=O)C2CCCCC2)C(C)C2=C1CCCC2

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MAPK1 P28482 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7928343 0.83 KDM4E (0.31) KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL7924767 0.82 ALDH1A1 (0.33) POLBMAPK1ALDH1A1
SCHEMBL7927387 0.80
SCHEMBL7925832 0.74 TSHR (0.34)
SCHEMBL28424440 0.74
SCHEMBL7924761 0.71
SCHEMBL7927170 0.71
SCHEMBL7924725 0.71 POLB (0.34) KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL7928308 0.71 POLB (0.34) KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL7928283 0.70 POLB (0.36) KDM4EPOLBL3MBTL1

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-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed