SCHEMBL7925495

SCHEMBL7925495

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

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
CYP1A2 P05177 2/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 2/20 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
SCHEMBL7919106 0.91 CYP1A2 (0.33) CYP1A2TSHRCYP2C19POLB
SCHEMBL7919194 0.85 LMNA (0.33) LMNACYP1A2TSHRCYP2C19ALDH1A1
SCHEMBL7925779 0.85 POLB (0.39) LMNACYP1A2TSHRCYP2C19ALDH1A1
SCHEMBL8158140 0.82 APOBEC3A (0.33) LMNATSHRKMT2APOLB
SCHEMBL7928731 0.82 POLB (0.32) ALDH1A1POLB
SCHEMBL7925499 0.81 RET (0.33) LMNA
SCHEMBL7930300 0.81 POLB (0.31) POLB
SCHEMBL7927839 0.81 POLB (0.31) POLB
SCHEMBL7925607 0.81 POLB (0.33) POLB
SCHEMBL7928620 0.80 KMT2A (0.36) LMNACYP1A2TSHRCYP2C19ALDH1A1

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 2 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
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed