SCHEMBL7927787

SCHEMBL7927787

CC(=O)O[Ti]1(OC(C)=O)C2C(=Cc3ccccc32)CCC2=Cc3ccccc3C21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 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
SCHEMBL7927559 0.91 POLB (0.35) POLBALDH1A1SMN1; SMN2TDP1LMNA
SCHEMBL7924683 0.86 ELANE (0.31) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7931007 0.85 LMNA (0.33) LMNA
SCHEMBL7919208 0.85 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7924741 0.83 LMNA (0.36) POLBALDH1A1TDP1LMNA
SCHEMBL7924666 0.82 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2TDP1LMNA
SCHEMBL7927402 0.82
SCHEMBL7925758 0.82 THRB (0.33)
SCHEMBL7924970 0.80 KCNN4 (0.39)
SCHEMBL7930983 0.79 POLB (0.35) POLBALDH1A1SMN1; SMN2TDP1LMNA

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