SCHEMBL7928618

SCHEMBL7928618

CCC(=O)O[Ti](OC(=O)CC)(OC(=O)CC)C1=CC=CC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.33
ESR1 P03372 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 1/20 0.30
WRN Q14191 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
SCHEMBL7928427 0.86 ALDH1A1 (0.36) KMT2AALDH1A1
SCHEMBL7924842 0.86 HIF1A (0.33) HIF1AESR1RECQLKMT2ASMN1; SMN2
SCHEMBL7927587 0.79
SCHEMBL7924706 0.75 ELANE (0.32)
SCHEMBL7927346 0.74
SCHEMBL7924920 0.74 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7927568 0.72 ALDH1A1 (0.36) ALDH1A1
SCHEMBL28622302 0.72 HIF1A (0.39) HIF1AESR1RECQLKMT2ASMN1; SMN2
SCHEMBL7931125 0.71 TSHR (0.43) HIF1ARECQLKMT2AALDH1A1CYP2C19
SCHEMBL27636311 0.71

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