SCHEMBL8461569

SCHEMBL8461569

C=CC(=O)OCCOc1ccc(C(=O)Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 2/20 0.43
HIF1A Q16665 1/20 0.43
MMP2 P08253 4/20 0.43
POLB P06746 1/20 0.42
MMP3 P08254 2/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40
F2 P00734 1/20 0.40
PRSS1 P07477 2/20 0.40
ACR P10323 2/20 0.40
NPC1 O15118 2/20 0.40
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL4350865 0.96 THRB (0.51) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL12723887 0.96 THRB (0.51) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL14379724 0.96 THRB (0.51) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL14469430 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9996975 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL14469738 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL16379515 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL11917944 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL12088389 0.94 ALDH1A1 (0.49) THRBALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL21500157 0.93 THRB (0.48) THRBALDH1A1MAPTCYP1A2CYP2D6

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5948864-A BLENDS ACUSHNET COMPANY (US) 1999-09-07 US claimed
WO-1999040977-A1 GOLF BALL INCORPORATING LIQUID CRYSTALLINE POLYMERS ACUSHNET COMPANY (US) 1999-08-19 WO claimed
US-20210189239-A1 LIQUID CRYSTAL COMPOSITION, RETARDATION FILM, METHOD FOR PRODUCING RETARDATION FILM, TRANSFER LAMINATE, OPTICAL MEMBER, METHOD FOR PRODUCING OPTICAL MEMBER, AND DISPLAY DEVICE DAI NIPPON PRINTING CO., LTD. (JP) 2021-06-24 US disclosed
US-9976085-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2018-05-22 US disclosed
US-9976085-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2018-05-22 US disclosed
US-20160122652-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-05-05 US disclosed
US-20160122652-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-05-05 US disclosed
US-20160122651-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-05-05 US disclosed
US-20160122651-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-05-05 US disclosed
US-20150361345-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-12-17 US disclosed
US-20150361345-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-12-17 US disclosed
US-7416765-B2 Polymerizable liquid crystalline composition and liquid crystal film made from the composition NIPPON OIL CORPORATION (JP) 2008-08-26 US disclosed
US-7416765-B2 Polymerizable liquid crystalline composition and liquid crystal film made from the composition NIPPON OIL CORPORATION (JP) 2008-08-26 US disclosed
US-20080170294-A1 RETARDATION FILM AND POLARIZING PLATE DAI NIPPON PRINTING CO., LTD. (JP) 2008-07-17 US disclosed
US-20080170294-A1 RETARDATION FILM AND POLARIZING PLATE DAI NIPPON PRINTING CO., LTD. (JP) 2008-07-17 US disclosed
US-20070164255-A1 POLYMERIZABLE LIQUID CRYSTALLINE COMPOSITION AND LIQUID CRYSTAL FILM MADE FROM THE COMPOSITION NIPPON OIL CORPORATION (JP) 2007-07-19 US disclosed
US-20070164255-A1 POLYMERIZABLE LIQUID CRYSTALLINE COMPOSITION AND LIQUID CRYSTAL FILM MADE FROM THE COMPOSITION NIPPON OIL CORPORATION (JP) 2007-07-19 US disclosed
EP-1405850-B1 (Meth)acrylic compound having an oxetanyl group and liquid crystal film produced by using the same NIPPON OIL CORP (JP) 2007-03-07 EP disclosed
US-5948864-A BLENDS ACUSHNET COMPANY (US) 1999-09-07 US disclosed
WO-1999040977-A1 GOLF BALL INCORPORATING LIQUID CRYSTALLINE POLYMERS ACUSHNET COMPANY (US) 1999-08-19 WO disclosed