SCHEMBL6344928

SCHEMBL6344928

CC1=CC(C)([Ti](C)(C)C)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
PGR P06401 3/20 0.35
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL6352941 0.82 ALDH1A1 (0.39) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL29374343 0.76 APOBEC3A (0.48) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL7258801 0.76 APOBEC3A (0.48) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL17008821 0.71 ALDH1A1 (0.42) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL4652338 0.71 ALDH1A1 (0.42) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL6345075 0.71 APOBEC3A (0.44) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
SCHEMBL19981030 0.71 ALDH1A1 (0.42) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
Hydrochloric Acid SCHEMBL6352938 0.69 ALDH1A1 (0.41) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
Hydrochloric Acid SCHEMBL6352945 0.69 ALDH1A1 (0.44) ALDH1A1CYP3A4HSD17B10TDP1KDM4E
Hydrochloric Acid SCHEMBL29097445 0.69 ALDH1A1 (0.44) ALDH1A1CYP3A4HSD17B10TDP1KDM4E

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6838409-B1 Catalyst for olefin/styrene copolymerization, and process for producing olefin/styrene copolymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2005-01-04 US disclosed
US-6562918-B1 A catalyst for olefin polymerization, which is obtained by contacting (A) a compound of a transition metal of Groups 4 to 6 of the Periodic Table, (B) an organoaluminiumoxy compound, and optionally (C) a carrier with each other, and for which IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2003-05-13 US disclosed
EP-1167393-A1 CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-01-02 EP disclosed
EP-1167394-A1 CATALYST FOR OLEFIN/STYRENE COPOLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN/STYRENE COPOLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-01-02 EP disclosed
US-6255244-B1 OBTAINED BY CONTACTING A TRANSITION METAL COMPOUND, AN OXYGEN-CONTAINING COMPOUND TO FORM AN IONIC COMPLEX, AND AN ADSORBING SUBSTANCE DURING OR AFTER THE CONTACTING TREATMENT, THEN FOLLOWED BY REMOVING THE ADSORBING SUBSTANCE. IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-07-03 US disclosed
EP-1085025-A1 CATALYST FOR OLEFIN POLYMERIZATION, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING OLEFIN POLYMER Idemitsu Petrochemical Co., Ltd. (JP) 2001-03-21 EP disclosed
EP-1085026-A1 CATALYST FOR POLYMERIZING STYRENE AND OTHER MONOMER AND PROCESS FOR PRODUCING STYRENE POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-03-21 EP disclosed