SCHEMBL7928240

SCHEMBL7928240

CCCC(=O)O[Ti]1(OC(=O)CCC)C2C(=Cc3ccccc32)[Si](C)(C)C2=Cc3ccccc3C21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
SLC18A3 Q16572 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7925595 0.90 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7930979 0.83 ALDH1A1 (0.37) ALDH1A1LMNACYP3A4CYP2D6CYP2C9
SCHEMBL7930983 0.82 POLB (0.35) ALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL7924666 0.82 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4CYP2D6CYP2C9
SCHEMBL7930317 0.79 ELANE (0.31) LMNA
SCHEMBL7925634 0.79 LMNA (0.37) ALDH1A1LMNACYP2D6TSHRSMN1; SMN2
SCHEMBL7930539 0.78 ELANE (0.31) ALDH1A1SMN1; SMN2TDP1
SCHEMBL7928108 0.78 THRB (0.32) ALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL7925121 0.78 LMNA (0.32) LMNA
SCHEMBL7930273 0.76 KCNN4 (0.41) LMNACYP2D6CYP2C19

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