SCHEMBL12792016

SCHEMBL12792016

Cc1cccc(C(F)(F)c2ccc(C)c(C)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.42
PTPN5 P54829 1/20 0.40
KIF11 P52732 3/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
RAPGEF4 Q8WZA2 1/20 0.38
KCNH2 Q12809 1/20 0.38
CYP19A1 P11511 1/20 0.38
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NFE2L2 Q16236 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL822098 0.89 ACHE (0.52) ACHEPTPN5KIF11CYP3A4CYP2D6
SCHEMBL822102 0.86 NFE2L2 (0.44) ACHEPTPN5KIF11CYP3A4CYP2D6
SCHEMBL822330 0.85 ALDH1A1 (0.42) ACHEKIF11CYP19A1HTTMEN1
SCHEMBL12792076 0.85 ACHE (0.39) ACHEPTPN5KIF11CYP3A4CYP2D6
SCHEMBL2622748 0.83 CYP19A1 (0.47) ACHEKIF11CYP3A4CYP2D6CYP19A1
SCHEMBL2631997 0.83 KIF11 (0.47) ACHEPTPN5KIF11CYP3A4CYP2D6
SCHEMBL11947060 0.83 ALDH1A1 (0.39) KIF11RAPGEF4KCNH2CYP19A1NFE2L2
SCHEMBL15764257 0.83 CYP19A1 (0.38) ACHEPTPN5KIF11CYP3A4CYP2D6
SCHEMBL12792054 0.81 TSHR (0.42) ACHEKIF11KCNH2CYP19A1MEN1
SCHEMBL148048 0.76 NFE2L2 (0.55) ACHEPTPN5KIF11RAPGEF4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8821617-B2 Polyimide-co-polybenzoxazole copolymer, preparation method thereof, and gas separation membrane comprising the same INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2014-09-02 US disclosed
US-8821617-B2 Polyimide-co-polybenzoxazole copolymer, preparation method thereof, and gas separation membrane comprising the same INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2014-09-02 US disclosed
US-20110065823-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME Industry-University Cooperation Foundation, Hanyan g University (KR) 2011-03-17 US disclosed
US-20110065823-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME Industry-University Cooperation Foundation, Hanyan g University (KR) 2011-03-17 US disclosed
WO-2009107889-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2009-09-03 WO disclosed