SCHEMBL19813085

SCHEMBL19813085

CC1=Cc2c(cccc2-n2c3ccccc3c3ccccc32)C1[Zr](C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.30
FTO Q9C0B1 1/20 0.30
GPR3 P46089 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
SCHEMBL3690622 0.88 ALDH1A1 (0.34) ALDH1A1KDM4EATML3MBTL1
SCHEMBL830787 0.85 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18188583 0.85 ALDH1A1 (0.33) ALDH1A1
SCHEMBL31253546 0.79 ALDH1A1 (0.39) ALDH1A1KDM4EATML3MBTL1ALKBH5
Hydrochloric Acid SCHEMBL3690620 0.79 ALDH1A1 (0.36) ALDH1A1KDM4EATML3MBTL1ALKBH5
SCHEMBL30472805 0.79 ALDH1A1 (0.39) ALDH1A1KDM4EATML3MBTL1ALKBH5
SCHEMBL830895 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EATML3MBTL1ALKBH5
SCHEMBL3759072 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EATML3MBTL1ALKBH5
SCHEMBL830788 0.76 ALDH1A1 (0.33) ALDH1A1KDM4EATML3MBTL1
Hydrochloric Acid SCHEMBL831359 0.75 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10654949-B2 High molecular weight functionalized olefin copolymer quenching agent EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-05-19 US disclosed
US-10450392-B2 Polymerization processes using high molecular weight polyhydric quenching agents EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-10-22 US disclosed
US-20190256619-A1 High Molecular Weight Functionalized Olefin Copolymer Quenching Agent EXXONMOBIL CHEMICAL PATENTS INC. 2019-08-22 US disclosed
US-20180030177-A1 Polymerization Processes Using High Molecular Weight Polyhydric Quenching Agents EXXONMOBIL CHEMICAL PATENTS INC. 2018-02-01 US disclosed