SCHEMBL5854037

SCHEMBL5854037

CCCCCCCCCCCC(=O)N[Zr](Cl)(Cl)(C1C=Cc2ccccc21)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
P2RX7 Q99572 1/20 0.37
SOAT1 P35610 3/20 0.36
ASAH1 Q13510 2/20 0.36
SOAT2 O75908 1/20 0.36
ALDH1A1 P00352 2/20 0.35
ACER2 Q5QJU3 1/20 0.35
FAAH O00519 2/20 0.35
CETP P11597 1/20 0.34
POLB P06746 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
SMPD2 O60906 1/20 0.34
SMPD1 P17405 1/20 0.34
EP300 Q09472 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33

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
SCHEMBL5854284 1.00 EPHX2 (0.39) EPHX2MEN1KMT2AP2RX7SOAT1
SCHEMBL5852559 0.99 EPHX2 (0.37) EPHX2MEN1KMT2AP2RX7SOAT1
SCHEMBL5855720 0.96 ADORA1 (0.34) EPHX2MEN1KMT2AP2RX7ALDH1A1
SCHEMBL5856043 0.92 ALOX5 (0.36) ALDH1A1
SCHEMBL5853751 0.89 P2RX7 (0.39) EPHX2MEN1KMT2AP2RX7SOAT1
SCHEMBL5855689 0.89 P2RX7 (0.39) EPHX2MEN1KMT2AP2RX7SOAT1
SCHEMBL5855340 0.87 P2RX7 (0.37) EPHX2MEN1KMT2AP2RX7SOAT1
SCHEMBL5854463 0.87 SIGMAR1 (0.31) MEN1KMT2A
SCHEMBL5856032 0.84 HTT (0.36) EPHX2MEN1KMT2AP2RX7ALDH1A1
SCHEMBL5856493 0.81 MEN1 (0.31) MEN1KMT2AALDH1A1

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
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed