SCHEMBL5853751

SCHEMBL5853751

CCCCCCCCCC(=O)N[Zr](Cl)(Cl)(C1C=Cc2ccccc21)[SiH](C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.39
EPHX2 P34913 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CETP P11597 1/20 0.36
SOAT1 P35610 3/20 0.36
ASAH1 Q13510 2/20 0.36
SOAT2 O75908 1/20 0.36
ALDH1A1 P00352 2/20 0.35
EP300 Q09472 1/20 0.35
ACER2 Q5QJU3 1/20 0.35
LMNA P02545 2/20 0.34
FAAH O00519 1/20 0.34
GAA P10253 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5855689 1.00 P2RX7 (0.39) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5855340 0.99 P2RX7 (0.37) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5856032 0.96 HTT (0.36) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5853457 0.91 ALOX5 (0.36) MEN1KMT2AALDH1A1GAANPC1
SCHEMBL5854284 0.89 EPHX2 (0.39) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5854037 0.89 EPHX2 (0.39) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5852559 0.87 EPHX2 (0.37) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL5854556 0.86 RET (0.31) MEN1KMT2A
SCHEMBL5855720 0.84 ADORA1 (0.34) P2RX7EPHX2MEN1KMT2ACETP
SCHEMBL6066698 0.82

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