SCHEMBL4045851

SCHEMBL4045851

C=CC[N+](F)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.33
▸ TSHR P16473 4/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ ALOX15 P16050 2/20 0.31
▸ RECQL P46063 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL5729478 0.76 ALDH1A1 (0.36) ALDH1A1TSHRLMNACYP2C19
SCHEMBL9818046 0.76 ALDH1A1 (0.36) ALDH1A1TSHRLMNACYP2C19
SCHEMBL2363937 0.74 ALDH1A1 (0.35) ALDH1A1TSHRLMNACYP2C19
SCHEMBL11652322 0.73 ALDH1A1 (0.33) ALDH1A1TSHRLMNAMAPTCYP2C19
SCHEMBL11649668 0.73 ALDH1A1 (0.33) ALDH1A1TSHRLMNACYP2C19
SCHEMBL7403368 0.71 ALDH1A1 (0.34) ALDH1A1TSHRLMNACYP2C19
SCHEMBL9298312 0.68 ALDH1A1 (0.32) ALDH1A1TSHRLMNAMAPTCYP2C19
SCHEMBL11652789 0.68 CYP2C19 (0.43) ALDH1A1TSHRCYP1A2LMNAGAA
SCHEMBL4042093 0.68 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL8076316 0.67 MIF (0.35) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050123778-A1 Polyolefins made by catalyst comprising a noncoordinating anion and articles comprising them EXXONMOBIL CHEMICAL PATENTS INC. 2005-06-09 — — US claimed
EP-1406761-A2 POLYOLEFINS MADE BY CATALYST COMPRISING A NONCOORDINATING ANION AND ARTICLES COMPRISING THEM ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2004-04-14 — — EP claimed
WO-2003000740-A2 POLYOLEFINS MADE BY CATALYST COMPRISING A NONCOORDINATING ANION AND ARTICLES COMPRISING THEM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-01-03 — — WO claimed
EP-1406761-B1 POLYOLEFINS MADE BY CATALYST COMPRISING A NONCOORDINATING ANION AND ARTICLES COMPRISING THEM EXXONMOBIL CHEM PATENTS INC (US) 2016-11-02 — — EP disclosed
US-7511104-B2 Polyolefins made by catalyst comprising a noncoordinating anion and articles comprising them EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-03-31 — — US disclosed
US-20050123778-A1 Polyolefins made by catalyst comprising a noncoordinating anion and articles comprising them EXXONMOBIL CHEMICAL PATENTS INC. 2005-06-09 — — US disclosed
EP-1406761-A2 POLYOLEFINS MADE BY CATALYST COMPRISING A NONCOORDINATING ANION AND ARTICLES COMPRISING THEM ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2004-04-14 — — EP disclosed
WO-2003000740-A2 POLYOLEFINS MADE BY CATALYST COMPRISING A NONCOORDINATING ANION AND ARTICLES COMPRISING THEM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-01-03 — — WO disclosed
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