SCHEMBL7927802

SCHEMBL7927802

CC(C)(C)C(=O)O[Ti](OC(=O)C(C)(C)C)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.33
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL7925544 0.88 ELANE (0.33) ELANEMAPTLMNANPSR1POLB
SCHEMBL7927122 0.84 POLB (0.42) MAPTLMNAPOLBALDH1A1TDP1
SCHEMBL7931012 0.83 KCNN4 (0.41)
SCHEMBL7931030 0.79 RET (0.37) ELANELMNAPOLB
SCHEMBL7919463 0.78 POLB (0.34) ELANEPOLB
SCHEMBL7927363 0.78 LMNA (0.39) MAPTLMNANPSR1POLBALDH1A1
SCHEMBL7919512 0.77 RET (0.36) MAPTLMNAPOLBALDH1A1
SCHEMBL7924994 0.77 THRB (0.32)
SCHEMBL7931102 0.77 ATM (0.31)
SCHEMBL7919128 0.74 POLB (0.41) LMNAPOLBALDH1A1TDP1

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