SCHEMBL20158014

SCHEMBL20158014

C=CC(=C)C(=O)c1ccc(C)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.60
CES1 P23141 3/20 0.60
ALDH1A1 P00352 6/20 0.48
HTT P42858 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
LMNA P02545 3/20 0.48
PKM P14618 2/20 0.48
ATM Q13315 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KMT2A Q03164 2/20 0.48
NLRP1 Q9C000 1/20 0.48
MEN1 O00255 1/20 0.48
NTSR1 P30989 1/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
TGM2 P21980 1/20 0.46
GAA P10253 1/20 0.43
MAPT P10636 2/20 0.42

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
SCHEMBL21261409 0.79 CES2 (0.60) CES2CES1SMN1; SMN2NPC1RAB9A
SCHEMBL10937781 0.78 AKT1 (0.58) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL13043540 0.78 CES2 (0.71) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL167254 0.77 CES2 (1.00) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL18998428 0.76 CES2 (0.68) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL2816739 0.76 CES2 (0.68) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL4903871 0.76 ALDH1A1 (0.67) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL28056567 0.75 CES2 (0.54) CES2CES1ALDH1A1HTTNPSR1
SCHEMBL1073763 0.73 ALDH1A1 (0.44) CES2CES1ALDH1A1HTTNPSR1
4-Methylbenzoic Acid SCHEMBL28740730 0.72 ALDH1A1 (0.74) CES2CES1ALDH1A1HTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3564280-B1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND STYRENE AND HYDRIDE THEREOF KURARAY CO (JP) 2023-07-26 EP claimed
EP-4163311-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2023-04-12 EP claimed
EP-4163312-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2023-04-12 EP claimed
US-11332567-B2 Copolymer of 1, 3, 7-octatriene and butadiene, hydride thereof, and method for producing said copolymer KURARAY CO., LTD. (JP) 2022-05-17 US claimed
US-11091578-B2 Copolymer of 1,3,7-octatriene and isoprene, hydride thereof, and method for producing said copolymer KURARAY CO., LTD. (JP) 2021-08-17 US claimed
US-20200095359-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND STYRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER KURARAY CO., LTD. (JP) 2020-03-26 US claimed
EP-3564280-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND STYRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP claimed
EP-3564279-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP claimed
EP-3564278-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND BUTADIENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP claimed
US-20190315899-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER KURARAY CO., LTD. (JP) 2019-10-17 US claimed
EP-4056604-B1 METHOD FOR PRODUCING COPOLYMER OF 1,3,7-OCTATRIENE AND STYRENE KURARAY CO (JP) 2023-08-02 EP disclosed
EP-3564280-B1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND STYRENE AND HYDRIDE THEREOF KURARAY CO (JP) 2023-07-26 EP disclosed
EP-4163311-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2023-04-12 EP disclosed
EP-4163312-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2023-04-12 EP disclosed
EP-4056604-A1 METHOD FOR PRODUCING COPOLYMER OF 1,3,7-OCTATRIENE AND STYRENE Kuraray Co., Ltd. (JP) 2022-09-14 EP disclosed
EP-3564280-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND STYRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP disclosed
EP-3564279-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP disclosed
EP-3564278-A1 COPOLYMER OF 1, 3, 7-OCTATRIENE AND BUTADIENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER Kuraray Co., Ltd. (JP) 2019-11-06 EP disclosed
US-20190315899-A1 COPOLYMER OF 1,3,7-OCTATRIENE AND ISOPRENE, HYDRIDE THEREOF, AND METHOD FOR PRODUCING SAID COPOLYMER KURARAY CO., LTD. (JP) 2019-10-17 US disclosed
WO-2018086605-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF 山东罗欣药业集团股份有限公司 2018-05-17 WO disclosed