SCHEMBL7925865

SCHEMBL7925865

C=[Ti](OC(=O)CC)(OC(=O)CC)(C1=CC=CC1)C1c2ccccc2-c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
CYP1A2 P05177 3/20 0.32
TSHR P16473 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL7919194 0.90 LMNA (0.33) POLBCYP1A2TSHRCYP2C19CYP3A4
SCHEMBL7927103 0.87 POLB (0.41) POLBGAA
SCHEMBL7919106 0.84 CYP1A2 (0.33) POLBCYP1A2TSHRCYP2C19CYP3A4
SCHEMBL7923901 0.84 KMT2A (0.33) POLBTSHRGAA
SCHEMBL7919133 0.84 POLB (0.33) POLB
SCHEMBL7927134 0.84 POLB (0.35) POLB
SCHEMBL7928341 0.84 POLB (0.33) POLBMAPT
SCHEMBL7925529 0.83 POLB (0.32) POLB
SCHEMBL7919280 0.81 KCNN4 (0.38) POLB
SCHEMBL7930752 0.80 MAPT (0.34) POLBGAAMAPT

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