SCHEMBL7928090

SCHEMBL7928090

C=C(C)C(=O)O[Ti]1(OC(=O)C(=C)C)C2C(=Cc3ccccc32)CC2=Cc3ccccc3C21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7924683 0.92 ELANE (0.31) ELANEALDH1A1SMN1; SMN2TDP1
SCHEMBL7927559 0.86 POLB (0.35) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7930539 0.82 ELANE (0.31) ELANEALDH1A1SMN1; SMN2TDP1
SCHEMBL7927323 0.80 ALDH1A1 (0.32) ELANEALDH1A1SMN1; SMN2TDP1
SCHEMBL7925489 0.80 LMNA (0.33) ELANE
SCHEMBL7930669 0.80 THRB (0.33)
SCHEMBL7930979 0.79 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7927198 0.78 LMNA (0.36) ALDH1A1TDP1
SCHEMBL7927787 0.78 POLB (0.35) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7930339 0.77

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